abstractsmaria mihet, mihaela lazar, ovidiu ardelean, monica dan, valer almasan - h/d isotopic...

Fifth Conference on Isotopic and Molecular Processes

PIM – 2007

AABBSSTTRRAACCTTSS September 20 – 22, Cluj-Napoca,

ROMANIA

TABLE OF CONTENT Program .........................................................................................................1

Invited lectures...............................................................................................9

Pietro Traldi – On the photochemical oxidation of benzene and its relevance at environmental level - ..........................................................................................11

Károly Vékey - Theoretical modeling of mass spectrometric reactions .............12

Paul Ewart – Optical diagnostics of moilecules with single mode and multi-mode lasers –.......................................................................................................13

Detlef Brinkmann - NMR in solid ionics and nanoionics...................................14

A.Kassiba, J.Bouclé, N.Errien, M.Makowska-Janusik - Physical properties and functionality of silicon carbide nanoparticles as isolated objects or structured in hybrid nanocomposites - .....................................................................................15

Stanislaw K. Hoffmann, - Local modes and phonons around paramagnetic defects in solids - ................................................................................................17

Narcyz Pislewski, - Clasical and quantum rotation observed in small molecular group by NMR -..................................................................................................18

Gion Calzaferri, - Mimicking the antenna system of green plants - ...................19

Yasuhiko Fujii, Masao Nomura, Tatsuya Suzuki, and Damian Axente - Isotope effects in electron exchange reactions of lanthanide and actinide elements including chemical uranium enrichment –..........................................................21

Kenji Takeshita, - Separation of trivalent minor actinides from lanthanides by thermosinsitive gels introducing functional ligand -...........................................22

Masami Shimizu, Kenji Takeshita - Simplified calculation method of deuterium separation factor between hydrogen and water (αH/D) depending on D-atom fraction of liquid water........................................................................................23

Grażyna Zakrzewska-Trznadel - Analysis of cascade systems for oxygen isotopes separation -............................................................................................24

Ana-Voica Bojar Franz Ottner, Dan Grigorescu, Hans-Peter Bojar - Environmental and tectonic record in the dinosaur bearing Maastrichtian deposits, Hateg Basin, Romania: insights from mineralogy and stable isotopes -............................................................................................................................26

István Fórizs - Isotopic characteristics of non-marine mollusk shells: decoding “paleo” information ............................................................................................28

National Institute for Research and Development of Isotopic and Molecular Technologies

Mino R. Caira, Welcome T. Mhlongo and Jinjing Li - Structural elucidation of chemically modified cyclodextrins and their inclusion complexes for medicinal applications .........................................................................................................29

Cristophe Fajolles - Recent developments in Amphiphilic Cyclodextrines: towards membrane functionalization ..................................................................30

Miklós Zrínyi - Magnetic- and electric field responsive soft materials -............31

Emil Roduner - A nanoscopic view of proton conductivity of fuel cell membranes -........................................................................................................32

Olivier Chauvet et al, - Elaboration, characterization and properties of carbon nanotubes / biopolymers hybrid nanocomposites and nanocomplex -................33

M. Jose Kenny , - Reserved subject -..................................................................34

Emmanuel Flahaut - Hybrid nanotubes: synthesis and characterisation - ..........35

Olivier Stephan et al, - Micro-nanostructuration of polymers, proteins and metallic materials by two-photon induced photochemistry - ..............................36

Rainer Kimmich, Markus Kehr, and Nail Fatkullin - Deuteron and proton spin-lattice relaxation dispersion of polymer melts: intra-segment, intra-chain, and inter-chain contributions -...................................................................................37

Oral presentations: mass spectrometry, chromatography, atomic and

molecular spectroscopy ...............................................................................39

P. Balas - Advanced analysis techniques in the study of nanomaterials.............41

Ioan Bratu - Solid state interactions of a new synthesized antimicrobian with β-ciclodextrin - .......................................................................................................42

Monica Culea - Comparative spectroscopic methods for rapid diagnosis -........43

Bele Constantin - Comparative analysis of biogenic amines and free amino acids in romanian cheeses -..........................................................................................44

Dan Chicea - Results of coherent light scattering dynamics on magnetic fluids computer simulation - .........................................................................................45

Francisc Vasile Dulf- Comparative studies on fatty acids’ and sterols’ GC-FID fingerprint of four edible, functional oils processed in Romania - .....................46

Adela Pintea - Chromatographic analysis of liophilic compounds in Nigella Sativa L. seeds - ..................................................................................................47

N. Palibroda, A. Mejean, N. Tandeau de Marsac, O. Barzu - EI mass spectrometry investigation of 13C and 15N labelling of cyanobacteria neurotoxins anatoxin-A and homoanatoxin-A - .....................................................................48

Oral presentation: biophysics and environmental physics ........................49

Iulia Lupan, Beatrix-Katalin Ferencz, Maria Chiriac, Nicolae Palibroda, Nadia Bucurenci, Octavian Popescu – Cloning and expression of bacterial genes coding amino acid dehydrogenases (oxidoreductases) .......................................51

Z. Moldovan, Gabriella Schmutzer, R. Chira, A. Alder - Determination of removal rate of the pharmaceuticals and personal care products (PPCPS) in the wastewater treatment plant from Cluj-Napoca, by GC/MS after SPE enrichment - ...........................................................................................................................52

C. Cosma, V. Benea, M. Moldovan, A. V. Cosma, , Alida Timar - Charcoal–TLD combined method used for radon monitoring - ..........................................53

Vasile V. Morariu - Autoregressive description of biological phenomena - ......54

Octavian Popescu - Glyconectin to glyconectin recognition as an adhesion self-assembly pathway leading to multicellularity - ..................................................55

Camelia Grosan, Monica Dan, Mihaela Lazar, Valer Almasan - Lignin degradation catalysed by polyoxometalates - .....................................................56

Mircea Giurgiu and Zaharie Moldovan - Characterization of surface water quality by acquisition of environmental data from distributed sensors - ............57

Oral presentation: isotope separation, labelled compounds and

applications, isotopes in nature...................................................................59

Damian Axente - Use of nuclear energy for hydrogen production.....................61

Dulf Henrietta, Dulf Francisc, Festila Clement - Operational models of the cryogenic distillation column for (13C) isotope...................................................62

Maria Chiriac, Flavia Popa, Iulia Lupan, O.Popescu, N. Palibroda - The biosynthesis of l-amino acids isotopically labelled with 15N ..............................63

Maria Mihet, Mihaela Lazar, Ovidiu Ardelean, Monica Dan, Valer Almasan - H/D isotopic exchange for evaluation of hydrogen spillover in gold supported catalysts...............................................................................................................64

Ilie Hodor - A novel procedure of hydrogen isotope separation based on chemical exchange and selective permeable membrane.....................................65

Paula Raica, D. Axente - Modeling and steady-state analysis of 15N isotope separation by chemical exchange in nitrox system.............................................66

Stela Cuna, Gabriela Balas, Nicolae Lupsa, Valentin Mirel, Edina Silagy, Alina Magdas - The study of the local sources of CO2 using stable isotopes...............67

Oral presentations: multifunctional and nanostructured molecular

systems..........................................................................................................69

M. Fardis, N. Panopoulos, G. Diamantopoulos, I. Rabias, G. Papavassiliou - Spin dynamics in molecular nanomagnets as probed with nuclear magnetic relaxation ............................................................................................................71


Radu Robert Piticescu - High pressure sinthesis of nanostructured materials for spintronics: state of the art and future prospects.................................................72

P.-O. Mouthuy, D. A. Serban, Y. Geerts, B. Nysten, A. Jonas, S. Melinte - Liquid crystal-based hybrid organic-inorganic devices ......................................73

S. Astilean, M. Baia, D. Maniu, L. Baia, C. Farcau, F. Toderas, M. Iosin, J. Popp, P. L. Baldeck - Nanoparticles and nanostructures to enhance vibrational and fluorescence spectroscopy............................................................................74

D. Lupu, A.R. Biriş, I. Baltog, M. Baibarac, V.Kuncser, G. Schinteie, M. Valeanu, G. Filoti, S. Lefrant, A.S. Biris and I. Mişan - Interface phenomena in carbon nanotube synthesis on MgO supported catalysts.....................................75

S. Simon, R.V.F. Turcu, D. Eniu - 27Al MAS-NMR investigation of yttrium aluminosilicate glasses containing gadolinium...................................................76

Traian Zaharescu, Silviu Jipa, Mihai Adrian - Nanostructured isotactic polypropylene-TiO2 systems...............................................................................77

Lidia Pop, Maria Bosca, Camelia Neamtu, Raveca Muntean, Eugen Culea - Structural and optical characteristics of some bismuthate glass with rare earth.78

Satelite workshop: Local Disorder at Nanoscale .......................................79

V. V. Grecu, Maria Nicoleta Grecu - Ferromagnetic resonance of magnetic nanoparticles, size and surface effects ................................................................81

S. Constantinescu, L. Diamandescu, D. Tarabasanu-Mihaila, I. Bibicu, M. Feder - 119Sn Mőssbauer spectroscopy study on the nanoscaled system. xSnO2-(1-x)α-Fe2O3 ...................................................................................................................82

S. Constantinescu - Static-disorder in Ca-Ga-Ge-trigonal and tetragonal structures investigated by Mössbauer technique.................................................83

Maria Nicoleta Grecu, V. V. Grecu, L.M. Giurgiu, T. Petrisor - Ferromagnetic resonance on thin magnetic layers ......................................................................84

L. Frunza, S. Frunza, A. Schonhals - Water behavior in restrictive geometry: its role in understanding the catalysis and sensors...................................................85

L. Frunza, S. Frunza, A. Schonhals - Local order in the surface layer: on the glassy state of some thermotropic liquid crystals confined to nanopores ...........86

A. Popa, M. Darques, L. Piraux, U. Ebels, L.M. Giurgiu - CO nanowires: structural and magnetic properties ......................................................................87

M. Popescu, F. Sava - Nanostructural disorder in hydrogenated amorphous silicon - a simulation study .................................................................................88

S. Georgescu, O. Toma, A .M. Chinie, L. Gheorghe, A. Achim and A.S. Stefan - Spectroscopic characteristics of partially disordered crystals LGS and LGT doped with Eu3+ ..................................................................................................89

E. Culea - Nanostructured phases in oxide glasses containing rare earth ions ...89

P. C. Fannin, C. N. Marin - Characteristic times of relaxation peaks of magnetic fluids ...................................................................................................................90

Corneliu Ghica, Leona Nistor - Revealing nanoscale structural ordering by TEM/HRTEM. application on PMn-Pt relaxor ferroelectric ..............................91

Satelite workshop: Advanced Polymeric Nanocomposites ........................93

Jiří Pfleger, Ondřej Dammer, Klára Podhájecká - π-conjugated polymer composites containing nanoparticles with plasmonic effects .............................95

B. Luszczynska, Z. Szamel, E. Dobruchowska, I. Glowacki, J. Ulanski - Molecularly doped polymers for blue-emitting OLEDs .....................................96

Jürgen Liebscher, Andreas Herrmann, Daniel Huster, Ioan Turcu - Functionalisation of nano-scaled lipid bilayered species by nucleic acids .........97

L. Vékás, Doina Bica, Rodica Turcu, I. Morjan, - Specially tailored magnetic nanoparticles and magnetic nanofluids: towards novel hybrid nanocomposites 98

Nicolae Aldea, Rodica Turcu, Alexandrina Nan, Izabella Craciunescu, Ovidiu Pana, Xie Yaning, Doina Bica, Ladislau Vekas, Dan Macovei - Crystalline and electronic structure of the nanostructured Fe3O4 polypyrrole core-shell composites determined by XRD, XAS and XPS ................................................99

O. Pana, O. Chauvet, C. Mijangos, C. Payen, E. Gautron, R. Turcu, C. M. Teodorescu, M.L. Soran, N. Aldea - Core-shell magnetic nanoparticles with noble metals and polymeric composites ...........................................................101

R. Turcu, A. Nan, I. Craciunescu, J. Liebsher, O. Pana, D. Bica, L.Vekas, - Comparative study of hybrid nanostructures polymer-magnetic nanoparticles102

R. Turcu, I. Craciunescu, A. Nan, M.L. Ciurea, I. Stavarache, V. Iancu, C. Popa - Polypyrrole – porous silicon nanocomposites ................................................103

A. Nan, I. Craciunescu, A. Bende, I. Bratu, R. Turcu, J. Liebscher - New strategies for development of functionalized polypyrrole ................................104

Izabell Craciunescu, Alexandrina Nan, Rodica Turcu, Lo Gorton, Delia Gligor, Ionel Catalin Popescu - Electrochemical studies of different functionalized polypyrrole........................................................................................................105

N.Crainic, Doina Bica, A.T.Marques Paulo J. Novoa, Nuno Correia - Nano-composite materials obtained using nano-magnetic fluids and resins ..............106

Poster presentations: T1 – Isotope separation, labelled compounds and

applications, isotopes in nature.................................................................107

Damian Axente, Cristina Narcu, Ecaterina Stela Dragan and Ecaterina Avram - The determination of adsorption capacity of anion exchange resin dowex-marathon for Ti(IV) and Fe(III) chlorocomplexes............................................109


Maria Chiriac, Flavia Popa, I.Bratu, Irina Kacso, G. Borodi, N. Palibroda - The syntheses of barbituric acid and some of its derivatives isotopically labelled with 15N.............................................................................................................110

Costinel Diana, Ionete Roxana Elena, Vremera Raluca - Food products authentification based on isotopic analysis, in concordance with the europeans standard.............................................................................................................111

Clement Festila, Andreea Stegaru, Tudor Buzdugan, Mihai Gligan - Liquid level transducer for cryogenic applications ...............................................................112

Eva-Henrietta Dulf, Andreea Stegaru, Tudor Buzdugan, Mihai Gligan - Monitoring and control system for (13C) isotope cryogenic separation column..........................................................................................................................113

Stela Cuna, Cornel Cuna, Berdea Petre, Gabriela Balas, Nicolae Lupsa, Valentin Mirel, Edina Silagy, Alina Magdas - The isotopic characterization of the mineral waters from the areal of the Oriental Carpathians ............................................114

Stela Cuna, Gabriela Balas - The measurements method of 13C/12C ratio from wine...................................................................................................................115

M.Kaucsár, D.Axente, V.Cosma, A.Bâldea - Improving transient response and reducing the effects of perturbations in isotope separation plants using a neuro-fuzzy controller .................................................................................................116

M.Kaucsár , Şt.Popescu - Mathematical modeling of SO2 flow control system to an isotopic separation column uzing artificial neuronal logic and fuzzy logic .117

Mihaela Ligia Ungureşan, Tiberiu Coloşi, Francisc Dulf - Modelling and simulation of the rapid interaction between Cu2+ and S2O3

2- in aqueous solution..........................................................................................................................118

Mihaela Ligia Ungureşan, Gavril Niac, Ioan Bâldea - A comparartive study concerning the dynamics of the reactants flow in the two observation cells for measuring the kinetics of the fast redox reaction Cu2+ with S2O3

2-...................119

Poster presentation: - T2: Multifunctional and nanostructured molecular

systems........................................................................................................121

I. Ardelean, M. Bogdan, A. Pirnau, and C. Badea - Molecular diffusion in permeable nanocapsules....................................................................................123

I.Ardelean, G.Farrher and R. Kimmich - Time dependent diffusion in partially filled porous samples ........................................................................................124

I. Ardelean, R. Lungu and P. Păşcuţă - Structural investigation of Fe2O3-B2O3-SrO glasses by raman spectroscopy..................................................................125

C. Horea, M. Toderas and I. Ardelean - Structural changes induced by MnO addition in 2P2O5·TeO2 glass matrix .................................................................125

Dorina Rusu and I. Ardelean - Structural and magnetic behavior of xFe2O3·(100-x)[Bi2O3·As2O3] glass system ...........................................................................126

V. Timar and I. Ardelean - Structural investigation of MnO-B2O3-PbO-Ag2O glass system by EPR spectroscopy ...................................................................127

Monica Toderas and I.Ardelean - Structural changes induced by MnO addition in B2O3⋅BaO glass matrix..................................................................................128

Raluca Ciceo Lucacel, Carmen Marcus, A. O. Hulpus and I. Ardelean - Characterization of 2P2O5·CaO·0.1ZnO glass matrix dopped with silver oxide..........................................................................................................................128

S. C. Baidoc and I. Ardelean - FT – IR and Raman spectroscopic studies of xAg2O·(100-x)[3B2O3·As2O3] glass system......................................................129

A. O. Hulpus, R. Ciceo Lucacel and I. Ardelean - Raman studies on CuO-B2O3-PbO-Ag2O glass systems ..................................................................................129

Carmen Marcus, Raluca Ciceo Lucacel and I. Ardelean - Structural studies on 2B2O3·Li2O·0.2GeO2 glass matrix doped with copper ions ..............................130

V. Simon, M. Todea, S. Simon - XPS study on silica–bismuthate glasses and glass ceramics ...................................................................................................131

P. Păşcuţă, S. Rada, L. Pop, M. Bosca and E. Culea - Magnetic behaviour of europium ions in bismuth-borate glass matrix ..................................................132

Lidia Pop, Maria Bosca, Camelia Neamtu, Raveca Muntean, Eugen Culea - Structural and optical characteristics of some bismuthate glass with rare earth..........................................................................................................................133

Carmen Tripon, Dana Toloman and Ioan Ardelean - The influence of transition metal ions on the structural characteristics of bismuthate glasses ....................133

S. Rada, E. Culea, M. Bosca, P. Pascuta - Effect of the introduction of the gadolinium ions in borotelurite glasses.............................................................134

Lidia Griguta and I. Ardelean - Structural and magnetic properties of lithium-borate glasses containing gadolinium ions........................................................135

Ovidiu Ardelean, Alexandru Biriş, Dan Lupu, Gabriel Popeneciu, Ioan Coldea, Ioan Mişan, Valer Almaşan - LaNi5-xMx alloy selection, suitable for hydrogen compressor ........................................................................................................136

A.R. Biriş , D. Lupu , I. Misan , E. Dervishi Zhongrui Li , S. Trigwell , A.S. Biris - Multi wall carbon nanotube synthesis by inductive heating ..................137

V. Cânpean, S. Aştilean, T. Petrişor jr., M. Gabor and I. Ciascai - Convective assembly of two-dimensional nanosphere lithographic masks .........................138


V. Almasan, A. Biris, I. Coldea, D. Lupu, I. Misan, G. Popeneciu, O. Ardelean - Ultrapure hydrogen thermal compressor based on metal hydrides for fuel cells and hybrid vehicles ...........................................................................................139

Corina Enache, Viorica Cosma, Cecilia Savii, Raluca Gavrila, Eugenia Fagadar-Cosma - Different catalysed sol-gel methods for obtaining silica- materials entrapping pyridilporphyrin ..............................................................140

Dana Vlascici, Elena Maria Pica, Eugenia Fagadar-Cosma Viorica Cosma, Otilia Bizerea - Thiocyanate and fluoride electrochemical senzors based on nanostructurated metalloporphyrin systems......................................................141

I. Bratu, Gh. Tomoaia, Gh. Borodi, I. Daian, Cs. Racz, A. Mocanu,I. Kacso, S. Santa and M. Tomoaia-Cotisel - Supramolecular associations of deferoxamine with β cyclodextrin and their self-assemblies...................................................142

I. Bratu, I. Daian, Gh. Tomoaia, Gh. Borodi, A. Mocanu, I. Kacso, and M. Tomoaia-Cotisel - Astaxanthin and β-cyclodextrin supramolecular associations investigated by FTIR, DSC, X-ray diffraction and molecular modeling ..........143

C. G. Floare - Methyl-substituted pyridine-water complexes revisited ............144

Crina Dan, Elisabeth-Jeanne Popovici, Florica Imre, Nicolae Popovici, Petre Mărginean and Ioan Silaghi-Dumitrescu - Synthesis and characterisation of some copper oxide catalysts for ozone decomposition .....................................145

Vasile V. Morariu, Maria Tomoaia-Cotisel, Diana Dubert, Gheorghe Tomoaia, Ramona Campean, Onuc Cozar and Aurora Mocanu - Interfacial properties of nanostructured lipid monolayers containing dimyristoyl phosphatidyl choline and neoglicolipid...............................................................................................146

C. Farcau, J. Bosson, N. Tosa, G. Vitrant, O. Stephan, S. Astilean, P.L. Baldeck - Two-photon laser fabrication and characterization of silver microstructures 147

Mihaela Hossu, D. Rusu, Mariana Rusu, O. Cozar, L. David - Structural and physical – chemical study of sandwich-type heteropolyoxometalate with dinuclear vanadium clusters..............................................................................148

Emil Indrea, Simina Dreve, T.D. Silipas, Ardelean Petru, Gheorghe Mihailescu, Liliana Olenic, Virginia Danciu, Veronica Cosoveanu, Laura Elena Muresan , Elisabeth-Jeanne Popovici, Violeta Popescu , Nascu Horea-Iustin, Vinteler Romulus Tetean , Gheorghe Lucian Baia , Terezia Nyari - Nanocrystalline TiO2 for photoelectrochemical generation of solar hydrogen....................................149

Emil Indrea, Simina Dreve, T.D. Silipas, Gheorghe Mihailescu, Liliana Olenic, Ardelean Petru, Virginia Danciu, Veronica Cosoveanu, Adrian Nicoara, Laura Elena Muresan, Elisabeth Jeanne Popovici, Violeta Popescu , Nascu Horea-Iustin, Vinteler Romulus Tetean , Gheorghe Lucian Baia , Terezia Nyari - Semiconductor photoelectrodes for solar water splitting................................150

Monica Iosin, Felicia Toderas, Patrice Baldeck and Simion Astilean - New routes for the synthesis of gold nanostructures as potential Surface-Enhanced Raman Spectroscopy (SERS) nanobioprobes ...................................................151

Mihaela Lazar, Valer Almasan, Stelian Pintea, Catalin Ducu, V. Malinovschi and Nicolae Aldea - Preparation and structural characterization by XRD and XAS of the supported gold catalysts.................................................................152

D. Lupu , A.R. Biriş, , I. Mişan - Hydrogen desorption from alanates catalyzed by ball milling...................................................................................................153

Klára Magyari, S. Simon, H. Mocuta, D. Lazar, F. Sima, I. N. Mihailescu - Investigation of bioactive nanostructured bioglass layers deposed on metallic support ..............................................................................................................154

Gheorghe Mihailescu , Liliana Olenic, Stela Pruneanu Ardelean Petru, Emil Indrea, Simina Dreve, T.Dan Silipas - Conductibility of GNP-amino acids structures...........................................................................................................155

Gheorghe Mihailescu , Liliana Olenic, Eugenia Fagadar- Cosma , Stela Pruneanu, Ardelean Petru, Emil Indrea, Simina Dreve, T.Dan Silipas -.Study of porphyrin cromophores as sensibilisators for photovoltaic solar cell ...............155

Laura Muresan, Elisabeth-Jeanne Popovici, Adrian-Raul Tomsa, Laura Silaghi-Dumitrescu, Lucian Barbu-Tudoran and Emil Indrea - Preparation by dip coating method and characterisation of WO3 thin films ...................................156

C. Neamtu, Al. Darabont - Melt growth of pure and Mn2+: doped KPb2Cl5 single crystals ..............................................................................................................157

C. Neamtu, D. Dadarlat, M. Streza, V. Simon - High precision measurements of thermal effusivity by photopyroelectric detection - experimental considerations..........................................................................................................................158

Violeta Niculescu, Nicolae Muresan, Costinel Lepadatu - New electron-transfer complexes of transitional metals with bidentate ligands of the naphthoquinone series .................................................................................................................159

Cristian V.L. Pop, Adrian Pirnau, Loredana Soran, Isabell Craciunescu, Alexandrina Nan - Nanostructures characterized by dynamic light scattering.160

A. Popa, G.Mihailescu, E. Indrea, C. V. Pop, D. Toloman,O. Raita, L.M.Giurgiu - Magnetic, structural and magnetic rezonance characterizations. influence of synthesis parameters ........................................................................................161

V. Almasan, A. Biris, I. Coldea, D. Lupu, I. Misan, G. Popeneciu, O. Ardelean - Metal hydride reactors with improved dynamic characteristics for hydrogen compression ......................................................................................................162


Elisabeth-Jeanne Popovici, Grigore Sigartau, Vladimir Graban, Adrian Cadis, Lelian Cioroianu and Adriana Bantas - Studies on the synthesis and characterisation of metallic fine powders for special coatings .........................163

Adrian-Raul Tomsa Elisabeth-Jeanne Popovici, Adrian Cadis, Maria Stefan, Lucian Barbu-Tudoran, and Simion Astilean - Ultrasound-assisted synthesis of nanocrystalline zinc sulphide powders .............................................................164

Zs. Sárközi, K. Kertész, A. A. Koós, Z. Osváth, L. Tapasztó, Z. E. Horváth, P. Nemes-Incze, I. Z. Jenei, Z. Vértesy, N. S. Daróczi, Al. Darabont, O. Pana, L. P. Biró - Synthesis of carbon nanotubes from benzene derivatives using a spray-pyrolysis method...............................................................................................165

Maria Ştefan, Elisabeth-Jeanne Popovici, Laura Mureşan, Rodica Grecu and Emil Indrea - Preparartion and characterisation of TiO2 thin films with special optical properties...............................................................................................166

A. Marcu, L. David, M.M. Venter, V.N. Bercean, M. Ilici and I. Haiduc - ESR studies on new transition metal complexes of mercaptothiadiazole-type ligands..........................................................................................................................167

A. Marcu, A. Stanila, M. Rusu, L. David - Structural investigations of some transitional metals with hystidine as ligand ......................................................168

Ioan Petean, Gheorghe Tomoaia, Ossi Horovitz, Aurora Mocanu and Maria Tomoaia-Cotişel - Cysteine mediated assembly of gold nanoparticles ............169

Lucian Barbu-Tudoran, Gheorghe Tomoaia, Ossi Horovitz, Aurora Mocanu and Maria Tomoaia-Cotişel - Self-assembly characteristics of gold nanoparticles in the presence of arginine ....................................................................................170

N. Tosa, G. Vitrant, P.L. Baldeck, O. Stephan, and I. Grosu - Fabrication of 3D metallic micro/nanostructures by two-photon absorption.................................171

V. Tosa, P. V. Mercea , O.G.Piringer A numerical model for impurities diffusion from multilayered plastics into foodstuff..........................................................172

Felicia Vasut, Marius Zamfirache, Claudia Pearsica, Anisoara Preda - Sorption of hydrogen on sponge titanium; parameters influencing the process..............172

E. Vinteler, C. Farcau, S. Astilean - Designing the colour of photonic crystals for sensors applications.....................................................................................173

Cezara Voica - Oxidic systems for ceramic coatings........................................174

Cezara Voica - The study of non-noxious ceramic colorants based on bismuth oxide..................................................................................................................175

I. Zaharie, R. Negrea, D. Popov - A quantum hydrodynamic model for a photovoltaic cell................................................................................................176

T. Beica, S. Frunza, R. Moldovan, I. Zgura, M. Poterasu, L. Frunza - Optical studies of the order in the lyotropic liquid crystals ...........................................177

D. Donescu, I. Zgura, M. Ghiurea, R. Somoghi, L. Frunza, S. Frunza - Polymer-clay nanocomposites: physico-chemical characterization ................................178

Poster presentations: T3: Mass spectrometry, chromatography, atomic

and molecular spectroscopy ......................................................................179

Mihaela Aluas, Carmen Tripon, Xenia Filip, Claudiu Filip - New insights into supramolecular architectures by solid-state NMR 1H-1H magnetization exchange..........................................................................................................................181

Radu Brătfălean, Silvia Neamţu, Ioan Turcu - Small angle scattering versus transmission for optical monitoring of aggregation processes..........................182

Virginia Coman, Rodica Grecu, Mihaela Băciuţ, Grigore Băciuţ Viorica Şimon - Thermal treatment effect on different bone matrices studied by FTIR spectroscopy......................................................................................................183

M. Streza, I. Broş, M.L. Soran, J. Leistner, N. Dădârlat, C. Neamţu - Sunflower oil degradation - study by chromatographic methods and accurate photopyroelectric calorimetry...........................................................................184

Violeta Niculescu, Roxana Lazar, Raluca Vremera, Vasile Stanciu, Radu Tamaian - HPLC method for acetic acid determination from grapes juice ......185

Miuţa Filip, Virginia Coman, Veronica Avram - RP-HPLC determination of some synthetic sweeteners from different soft drinks and wines......................186

Veronica Avram, Mihaela Vlassa, Virginia Coman - Separation and detection of some natural sweeteners from different wines by thin layer chromatography .187

Stefania Simon, Zaharie Moldovan and Virginia Coman - Chromatographic and mass spectrometric methods for the detection of wine adulteration with sweeteners .........................................................................................................188

Stoica Hopirtean Ioana, Hopartean Ionel, Stoica Hopirtean Dacian - Miniaturised sensors for voltammetry determination of some synthetic sweeteners in wines...........................................................................................189

Monica Culea, Paraschiva Chereches-Panţa, Mircea Nanulescu, Cornelia Mesaros - Diagnosis of hepatic dysfunction diseases by isotopic dilution GC/MS..........................................................................................................................190

Monica Culea, Adela Pintea, Mirela Jimborean, Onuc Cozar - GC/MS determination of nutrients in biological samples ..............................................191

Monica Culea, Andreea Iordache, Monica Nemtanu, R. Minea GC/MS study of sea buckthorn oil ...............................................................................................192


Radu Tamaian, Ioan Ştefănescu, Roxana Lazăr - Mass-spectrometry – a method for determination of deuterium distribution in birds’ body under effect of water with low deuterium content ..............................................................................193

Z. Moldovan, O. Marincas and Veronica Avram - Mass spectrometric methods for determination of synthetic antioxidants ......................................................194

Zaharie Moldovan, Olivian Marincas - Determination of pesticide residues in waters samples using GC/MS system after SPE pre-concentration..................195

Simona Nicoara, N. Palibroda, L. Tonidandel, P. Traldi, Nicoleta Tosa, Aniela Vizitiu - Mass spectra interpretation of newly synthesized dioxanic compounds with liquid crystals properties ...........................................................................196

D. Ioanoviciu, C. Ciortea, V. Cosma, C. Cuna, I. Albert - Aberrations of three deflector double focusing recoil mass spectrometers........................................197

C.Cuna, D. Ursu, M.Leuca, Stela Cuna and A.Pamula GC –ion mobility spectrometer system experimentation...............................................................198

Edward Muntean Tania Mihăiescu Nicoleta Muntean, Radu Mihăiescu - Non-suppressed ion chromatographic assesment of chloride, nitrate and sulfate in surface waters from fizes watershed .................................................................199

D. Dadarlat, C. Neamtu, R. Pop, M. Marinelli, F. Mercuri - On the selection of the experimental parameters in a Thermal-Wave-Resonator-Cavity (TWRC) configuration .....................................................................................................200

Cornelia Vasile, Doina Macocinschi, Maria Cristina Popescu, Maria Lungu - Physical characterization of compatibilizated polyurethane-based biomaterials..........................................................................................................................201

C.Cuna, E.Indrea, Şt.Popescu, D.Ursu. - Analog signal acquisition with non national instruments input board.......................................................................202

C.Cuna, Şt.Popescu, M.Kaucsár - Digital signal acquisition whith non national instruments input/output board .........................................................................203

Elisabeth-Jeanne Popovici, Florica Imre-Lucaci, Laura Muresan, Maria Stefan, Ecaterina Bica, and Emil Indrea - Spectral investigations on niobium and rare earth activated yttrium tantalate powders .........................................................204

T. Ristoiu, L. Ciontea, R.-C. Suciu, T.Petrisor -Jr., M.Gabor, G.. Thalmayer, T. Petrisor - Thermal decomposition study by TG-MS-DTA of cerium [III] acetylacetonate used as ceria thin film precursor..............................................205

Alina Saponar, Elisabeth-Jeanne Popovici, Nicolae Popovici, Ecaterina Bica, Gabriela Nemes and Ioan Silaghi-Dumitrescu - Narrow RIM alkenyl calix[n]arene. synthesis and spectral characterization ......................................206

Ioan Suciu, Constantin Cosma and Mihai Todica - Comparative study ICP and NAA for determining the heavy metals traces..................................................207

Carmen Tripon, Mihaela Aluas, Xenia Filip, Claudiu Filip - New solid state-NMR methods for investigating molecular structure: the CHCC approach .....208

Carmen Tripon, Mihaela Aluas, Xenia Filip, Claudiu Filip - Increasing the accuracy of structural investigations in molecular devices by advanced solid-state NMR methods...........................................................................................209

Claudiu Filip, Mihaela Aluas, Carmen Tripon, Xenia Filip - New methodological approaches in solid-state NMR ...............................................210

M.M. Venter, V.N. Bercean, S. Cîntă Pînzaru, A.E. Pascui, M. Ilici and I. Haiduc - Structure determination of new nitrogen-containing heterocyclic derivatives using single-crystal X-ray diffraction.............................................211

Loris Tonidandel , Eugenio Ragazzi, Guido Roghi and Pietro Traldi - Mass spectrometry in characterization of ambers. I. Studies by laser desorption ionization, atmospheric pressure chemical ionization and atmospheric pressure photoionization mass spectrometry...................................................................212

Poster presentations: T4: Biophysics and environmental physics ..........213

Silvia Neamţu, Radu Brătfălean, Ioan Turcu, Ioana Bâldea - Fibroblasts aggregation monitoring by small angle scattering measurements ....................215

Nicolae-Marius Bârlea, Sânziana Iulia Bârlea, Eugen Culea Maxwell-Wagner effect in the human skin....................................................................................216

Diana Bogdan, Vincent Smith, Mihai Vasilescu,Mircea Bogdan, Mino R. Caira, Simion Simon - 1H NMR study of inclusion complexes of phenylurea derivatives in α-cyclodextrin.............................................................................217

C. Bindea - The efect of magnetic field on Li+ transport through human erythrocyte membranes.....................................................................................218

S. Boca, A. Bonne, G. Lemercier, C. Andraud, B. Van der Sanden, R. Clement, S. Astilean, P.L. Baldeck - Two-photon photodynamic therapy of cancer cells using ruthenium(II) complexes .........................................................................219

I. Bratu, Gh.Borodi, Irina Kacsó, Daniela Constantinescu, and S.I. Farcas - Solid and liquid state inclusion complexes of metoclopramid with β-cyclodextrin.......................................................................................................220

I. Broş, S. Cobzac, E. Surducan, V. Surducan, T. Hodişan - Determination of optimal conditions for microwave-assisted extraction of bioactive compounds from SATUREJA HORTENSIS L ......................................................................221

Felicia Bucura, David Elena, Marius Constantinescu, Sisu Claudia, Niculescu Violeta - Recovery and purification of hydrogen using PSA technology.........222

Luiza Buimaga-Iarinca, Silvia Neamţu, V.V. Morariu, C. Craciun - Ultrastructural changes of leaves in zero magnetic field. a quantitative images analysis..............................................................................................................223


Luiza Buimaga-Iarinca and Vasile V. Morariu - Detrended fluctuation analysis and autoregressive modeling of the erythrocyte flickering...............................224

Ramona Chelcea, Eugen Culea and Radu Fechete - Microscopic networks properties correlations of gelly cosmetics materials .........................................225

C. Cosma, Alida Timar, V. Benea, Daniela Ciorba, I. Pop - Using natural luminiscent materials and MCP-N (LiF:Mg,Cu,P) Chips in environmental dosimetry ..........................................................................................................226

Simina Dreve, Emil Indrea, Dan Teofil Silipas, Rodica-Mariana Ion, Rodica Cosgarea, Adriana Filip , Maria Perde-Schreppler, Ioana Brie - Chitosan-based hydrogels with porphyrins for photodynamic therapy......................................227

Simina Dreve, Emil Indrea, Dan Teofil Silipas, Rodica-Mariana Ion, Rodica Cosgarea, Adriana Filip , Maria Perde-Schreppler, Ioana Brie - Bioactivity of new chitosan formulations for photodynamic therapy......................................228

S.I.Farcas, I. Bratu, Irina Kacsó, Gh. Borodi and M. Bogdan - Solid and liquid state inclusion complexes of some gastrointestinal drugs with β-cyclodextrin. preliminary results ............................................................................................229

Xenia Filip, Carmen Tripon, Mihaela Aluas, Claudiu Filip - New solid state-NMR techniques for investigating structure and dynamics in soft solids and biomaterials.......................................................................................................230

Diana Florescu, G. Saros, Irina Saros,M.Constantinescu, V. Stanciu, Roxana Ionete - Influnce of antrophic sources on the carbon oxides levels and monitoring by mass spectrometry and gas chromatography.............................231

D. Grecu, A.S. Carstea, A.T. Grecu, Anca Visinescu - One-component spherically symmetric model of a non-necrotic tumor growth .........................232

I. Bratu, Irina Kacso, G. Borodi, Ioana Mindrutau, Lucia Rus, Felicia Dragan and M. Bojita - Solid state interactions of simvastatin with β-cyclodextrin.....233

M.Kaucsár, C.Cuna, V.Bunea, S.Olteanu, D.Zotoiu - Electrolytic conductivity detector in pollutants monitoring system..........................................................234

Silvia Neamţu, Vasile V Morariu - The vegetative growth of plants in zero magnetic field....................................................................................................235

Violeta Niculescu, Elena David, Vasile Stanciu, Marius Constantinescu, Felicia Bucura - Valorization of biomass to produce hydrogen and PSA purification method ..............................................................................................................236

I. Petrescu, D. Ristoiu, I. Haiduc and T. Ristoiu - Global climatic reheating and its physical impact.............................................................................................237

A. Pîrnău, M. Bogdan - Investigation of the interaction between naproxen and human serum albumin.......................................................................................238

V. Simon, O. Ponta, S. Simon, M. Neumann - Atomic environment changes induced by rare earths addition to heavy metal glasses ....................................239

Ioan Suciu, Constantin Cosma and Mihai Todica - Variations of heavy metals concentration in soil at differents depts in some transylvanian areals ..............240

Cristina Barbu, Anisoara Preda, Popescu A. and Selisteanu D. - The determination of the concentrations of heavy metals on the jiu river using ICP-MS, and on the olt river using AAS..................................................................241

Gabriella Schmutzer, Zaharie Moldovan, Virginia Danciu, Florin Vasiliu - Photodegradation of organic pollutants under uv irradiation in the presence of TiO2 ..................................................................................................................242

A. Pamula, Cezara Voica, R. Chira, C. Cuna - Heavy metal traces in some surface waters from North – Western Transylvania .........................................243

Kovacs Melinda Haydee1 Dumitru Ristoiu and Urs Von Gunten - Disinfection byproducts formation after chlorination in Cluj - Napoca city .........................244

Kovacs Melinda Haydee, Dumitru Ristoiu, Urs Von Guntenand Radu Mihaiescu - Factors that influence the THMS formation kinetics during disinfection of drinking water in the distribution system..................................244

Vasile Surducan, Emanoil Surducan - Humidity and temperature meter device for continous tracking of growing plants ..........................................................245

Felicia Toderas, Monica Baia, Dana Maniu, and Simion Astilean - Tuning plasmon resonances of gold nanoparticles by controlling their size and shape246

M. Todica, C. V.Pop, E. Dinte , S. Astilean - Some physical properties of polymeric matrix with pharmaceutical applications .........................................247

Florina Tusa, Z. Moldovan, Cezara Voica - Determination of micropolluants in aqueous medium by liquid-liquid extraction and GC/MS method ...................248

Raluca Vremera, Diana Costinel , Violeta Niculescu, Roxana Lazar, Vasile Stanciu - A new method for chlorinated organic compounds determination from drinking and residual waters .............................................................................249

Z. Truta, Stela Lerintiu, Marinela Garlovanu, V.V.Morariu - Human haploid male germ cells trajectory in zero magnetic fields............................................250

Ioan Turcu, Silvia Neamţu, Cristian V.L. Pop - Angular spreading of scattered light used to investigate platelets aggregation ..................................................251

Mihaela Vladu, Anisoara Preda, Felicia Vasut, Claudia Pearsica, Cristina Barbu - Experimental study about determination of gamma-activ isotopes from environment samples (soil, vegetation, sediments)...........................................252


M. Vladu, A. Preda, F. Vasut, C. Pearsica, A. Ghitulescu - Calculation of the radionuclides dispersion in atmosphere, as the results of operating a cryogenic pilot plant ..........................................................................................................253

Oana Zainea, Vasile V. Morariu and Calin Vamos - Haemophilus Influenzae 86-028np genome by detrended fluctuation analysis........................................254

Author Index..............................................................................................255

Fifth Conference on Isotopic and Molecular Processes, PIM-2007

1

PROGRAM

Thursday, September 20, 2007 Place: Napoca Hotel

Conference hall "A"

8 30 - 8 45 Opening of the 5th PIM Conference

Invited lectures

845 - 915 Pietro Traldi et al, " On the photochemical oxidation of benzene and its relevance at environmental level"

915 - 945 Karoly Vekey, " Theoretical modeling of mass spectrometric reactions "

945 - 1015 Paul Ewart, "Optical diagnostics of molecules with single-mode and multi-mode lasers"

1015 - 1045 Detlef Brinkmann, "NMR in solid ionics and nanoionics"

1045 - 1115 Coffee break

1115 - 1145 Abdelhadi Kassiba et al, "Physical properties and functionality of silicon carbide nanoparticles as isolated objects or structured in

hybrid nanocomposites"

1145 - 1215 Stanislaw K. Hoffmann, "Local modes and phonons around paramagnetic defects in solids"

1255 - 1245 Narcyz Pislewski, "Clasical and quantum rotation observed in small molecular group by NMR"

1245 - 1315 Gion Calzaferri, "Mimicking the antenna system of green plants"

1315 - 1500 Lunch break

Conference hall "A" T3 topic

Conference hall "B" T4 topic

1500 - 1515 P. Bălaş: “Advanced analyses techniques in the

study of nanomaterials” 1500 - 1515

Octavian Popescu et al: "Cloning and expression of

bacterial genes coding

amino acid dehydrogenases

(oxidoreductases)"


2

1515 - 1530

Ioan Bratu et al: "Solid state interactions of a new

synthesized antimicrobian

with b-cyclodextrin"

1515 - 1530

Zaharie Moldovan et al: "Determination of removal

rate of the pharmaceuticals

and personal care products

(PPCOs) in wastewater

treatment plant from Cluj-

Napoca"

1530 - 1545

Monica Culea et al: "Comparative spectroscopic

methods for rapid

diagnosis"

1530 - 1545

Constantin Cosma et al: "Charcoal–TLD combined

method used for radon

monitoring"

1545 - 1600

Constantin Bele et al: "Comparative Analysis of

Biogenic Amines and Free

Amino Acids in Romanian

Cheeses"

1545 - 1600 Vasile V. Morariu et al: "Autoregressive description

of biological phenomena"

1600 - 1615

Dan Chicea: "Results of Coherent Light Scattering

Dynamics on Magnetic

Fluids Computer

Simulation"

1600 - 1615

Octavian Popescu: "Glyconectin to glyconectin

recognition as an adhesion

self-assembly pathway

leading to multicellularity"

1615 - 1630

Vasile Francisc Dulf et al: "Comparative studies on

fatty acids' and sterols' GC-

FID fingerprint of four

edible, functional oils

processed in Romania"

1615 - 1630

Camelia Grosan et al: "Lignin degradation

catalysed by

polyoxometalates"

1630 - 1645

Adela Pintea et al: "Chromatographic analysis

of lipophilic compounds in

Nigella Sativa L. seeds "

1630 - 1645

Mircea Giurgiu et al: "Characterization of Surface

Water Quality by

Acquisition of

Environmental Data from

Distributed Sensors "

1645 - 1700

Nicolae Palibroda et al: "EI mass spectrometry

investigation of 13C and 15N

labelling of cyanobacteria

neurotoxins anatoxin-a and

homoanatoxin-a "

1645 - 1700


1730 - 1930 Poster session topics T3 & T4


3

2000 - Cocktail

Friday, September 21, 2007 Place: Napoca Hotel

Conference hall "A" Invited lectures

845 - 915 Ysushiko Fujii et al, "Isotope effects in electron exchange reactions of lanthanide and actinide elements including chemical

uranium enrichment"

915 - 945 Kenji Takeshita, "Separation of trivalent minor actinides from lanthanides by thermosinsitive gels introducing functional ligand"

945 - 1015 Masami Shimizu, "Simplified calculation method of deuterium separation factor between hydrogen and water (αH/D) depending on

D-atom fraction of liquid water"

1015 - 1045 Grazyna Zakrzewska-Trznadel, "Analysis of cascade systems for oxygen isotopes separation"


1115 - 1145 Ana-Voica Bojar et al, "Environmental and tectonic record in the dinosaur bearing Maastrichtian deposits, Hateg Basin, Romania:

insights from mineralogy and stable isotopes"

1145 - 1215 István Fórizs, "Isotopic characteristics of non-marine mollusk shells: decoding "paleo" information"

1255 - 1245 Mino Caira, "Structural elucidation of chemically modified cyclodextrins and their inclusion complexes for medicinal

applications"

1245 - 1315 Christophe Fajolles, "Recent developments in Amphiphilic Cyclodextrines: towards membrane funtionalization"


Conference hall "A" T1 topic

Conference hall "B" T2 topic

1500 - 1515 Damian Axente: "Use of nuclear energy for hydrogen

production" 1500 - 1515

Michael Fardis et al.: "Spin Dynamics in Molecular

Nanomagnets as probed

with Nuclear Magnetic

Relaxation"


4

1515 - 1530

Eva-Henrietta Dulf et al: "Operational Models of the

Cryogenic Distillation

Column for (13C) Isotope"

1515 - 1530

Radu Robert Piticescu et al: "High pressure synthesis of nanostructured materials

for spintronics: state of the

art and future prospects"

1530 - 1545

Maria Chiriac et al: "The Biosyntheses of L-amino

acids Isotopically Labelled

with 15N."

1530 - 1545 Sorin Melinte et al: "Liquid crystal-based hybrid

organic-inorganic devices"

1545 - 1600

Maria Mihet et al: "H/D isotopic exchange for

evaluation of hydrogen

spillover in gold supported

catalysts"

1545 - 1600

Simion Astilean et al: "Nanoparticles and

Nanostructures to Enhance

Vibrational and

Fluorescence Spectroscopy"

1600 - 1615

Ilie Hodor: "A novel procedure of hydrogen

isotope separation based on

chemical exchange and

selective permeable

membrane"

1600 - 1615

Dan Lupu et al: "Interface phenomena in carbon

nanotube synthesis on MgO

supported catalysts "

1615 - 1630

Paula Raica et al: "Modeling and steady state

analysis of 15N separation

by chemical exchange ion

nitrox system"

1615 - 1630

Simion Simon et al.: "27Al MAS-NMR investigation of

yttrium aluminosilicate

glasses containing

gadolinium"

1630 - 1645 Gabriela Balas et al: "The study of the local sources of

CO2 using stable isotopes" 1630 - 1645

Traian Zaharescu et al: "Nanostructured isotactic

polypropylene-TiO2 systems"

1645 - 1700

Lidia Pop et al: "Magnetic properties of some

bismuthated glasses with

rare-earth ions"


1730 - 1930 Poster session topics T1 & T2

2030 - Conference dinner


5

Saturday, September 22, 2007 Place: Napoca Hotel, conference hall "C"

Invited lectures

845 - 915 Miklós Zrínyi, "Magnetic- and electric field responsive soft materials"

915 - 945 Emil Roduner et al, "Nanoscale Resolution Proton Conductivity Measurements of Fuel Cell Membranes"

945 - 1015 Olivier Chauvet et al, "Elaboration, characterization and properties of carbon nanotubes / biopolymers hybrid

nanocomposites and nanocomplex"

1015 - 1045 M. Jose Kenny , "Reserved subject"


1115 - 1145 Emmanuel Flahaut, "Hybrid Nanotubes: synthesis and characterisation"

1145 - 1215 Olivier Stephan et al, "Micro-nanostructuration of polymers, proteins and metallic materials by two-photon induced

photochemistry"

1255 - 1245 Rainer Kimmich et al, "Deuteron and proton spin-lattice relaxation dispersion of polymer melts: intra-segment, intra-chain,

and inter-chain contributions"

1245 - 1300 Closing PIM-2007


1430 - Social program

SATELITE WORKSHOPS

Thursday, September 20, 2007 "LOCAL DISORDER AT NANOSCALE"

1500 - 1515 Voicu V. Grecu et al.: "Ferromagnetic resonance of magnetic nanoparticles, size and surface effects"

1515 - 1530 S. Constantinescu: "Static disorder in Ca-Ga-Ge trigonal and tetragonal structures investigated by Mossbauer technique"

1530 - 1545 S Constantinescu et al.: "119Sn Mossbauer spectroscopy on the nanoscaled system xSnO2(1-x)α-Fe2O3"


6

1545 - 1600 Nicoleta Maria Grecu et al.: "Ferromagnetic resonance on thin magnetic layers"

1600 - 1615 Ligia Frunza et al.: "Water behaviour in restrictive geometry: its role in understanding the catalysis and sensors"

1615 - 1630 Ligia Frunza et al.: "Local order in the surface layer: on the glassy state of some thermotropic liquid crystals confined to

nanopores"

1630 - 1645 Adriana Popa: "CO nanowires:structural and magnetic properties"

1645 - 1700 M. Popescu et al.: "Nanostructural disorder in hydrogenated amorphous silicon-a simulation study."


1730 - 1745 A. M. Voiculescu et al.: "Spectroscopic characteristics of partially disordered crystals LGS and LGT doped with Eu3+."

1745 - 1800 C. N. Marin et al.: "Characteristic times of relaxation peaks of magnetic fluids."

1800 - 1815 E. Culea: "Nanostructured phases in oxide containing rare earth ions."

1815 - 1830 C. Ghica et al.: "Revealing nanoscale structural ordering by TEM/HRTEM. Application on PMN-PT relaxor ferroelectric."

1830 - 1845 P. C. Fannin: "Reserved subject."

Friday, September 21, 2007 "ADVANCED POLYMERIC NANOCOMPOSITES"

1500 - 1515 Jiri Pfleger et al.: "pi-Conjugated polymer composites containing nanoparticles with plasmonic effects. "

1515 - 1530 Jacek Ulanski et al.: "Molecularly doped polymers for blue-emitting OLEDs."

1530 - 1545 Jurgen Liebscher et al.: "Functionalisation of nano-scaled lipid-double layered species."

1545 - 1600 Ladislau Vekas et al.: "Reserved subject."

1600 - 1615 Nicolae Aldea et al.: "Crystalline and electronic structure of the nanostructured Fe3O4 polypyrrole core-shell composites

determined by XRD, XAS and XPS"


7

1615 - 1630 Ovidiu Pana et al.: "Core-shell magnetic nanoparticles with noble metals and polymeric composites"

1630 - 1645 Turcu Rodica et al.: "Comparative study of hybrid nanostructures polymer-magnetic nanoparticles"

1645 - 1700 Magdalena Lidia Ciurea et al.: "Polypyrrole-porous silicon nanocomposites."


1730 - 1745 Alexandrina Nan et al.: "New strategies for development of functionalized polypyrroles."

1745 - 1800 Izabell Craciunescu et al.: "Electrochemical studies of different functionalized polypyroole"

1800 - 1815 Nicolae Crainic et al. “Nano-composite materials obtained using nano-magnetic fluids and resins”


8


9

INVITED LECTURES


10


11

ON THE PHOTOCHEMICAL OXIDATION OF BENZENE AND ITS RELEVANCE AT ENVIRONMENTAL LEVEL

Laura Stella1, Roberta Seraglia1, Alberto Sturaro2, Rocco Rella2 and

Pietro Traldi 1*

1 CNR-ISTM, Corso Stati Uniti 4, Padova , Italy 2 CNR-IDPA, Corso Stati Uniti 4, Padova , Italy

Benzene is one of the most monitored pollutants, due to its high level in high

traffic and industrial areas. Previous investigations, performed by atmospheric pressure photoionization1,2,

have shown that under light irradiation benzene reacts with oxygen, leading to phenol production. The same reaction has been observed by sunlight irradiation of benzene samples, as proved by GC/MS analyses. The phenol/benzene chromatographic peak ratio passes from 1.8×10-4 to 0.105 after 6 hours of sunlight irradiation, giving evidence that phenol can be produced at environmental level. To prove the validity of this hypothesis weekly air sampling was performed over a year (2006) and phenol/benzene ratio was found to be related to the sun radiation. It ranges from 0.046 to 1.114 and higher values are obtained for the late summer – early autumn period, when the sunlight exposure is higher. Considering that the LC50 values for inhalation of benzene and phenol are 9980 and 42 ppm respectively, it follows that the monitoring of phenol in air is an important point to be followed to ensure a valid air quality.

1. Robb, D. B.; Covey, T . R. ; Bruins, A. P. Atmospheric Pressure Photoionization: An Ionization Method for Liquid Chromatography-Mass Spectrometry Anal. Chem. 72, 3653-3659 (2000).

2. Tubaro, M., Marot ta , E . , Seragl ia , R. Traldi , P . Atmospheric pressure photoionization mechanisms. 2. The case of benzene and toluene. Rapid Commun. Mass Spectrom. 17, 2423-

2429 (2003).


12

THEORETICAL MODELING OF MASS SPECTROMETRIC REACTIONS.

Károly Vékey

Mass Spectrometry Department,Chemical Research

Center, Hungarian Academy of Sciences,

H-1025 Budapest II, Pusztaszeri út 59 - 67

Fragmentation reactions occurring in a mass spectrometer has been the basis of its applications in analytical and structural chemistry. Modeling these reactions have been attempted for over 50 years, with varying success. The main issues are ion structures, energetics, reaction kinetics, instrument effects, and neither of these are well known. Most experiments yield indirect information only, so theoretical methods are of prime importance to support, to understand and to complement experimental results. The two most relevant theoretical fields are quantum chemistry and reaction kinetics. After a short description of the application of quantum chemistry in mass spectrometry, the approach using reaction kinetic calculations will be explained. In this field energetics and excitation processes are of prime importance. Modeling does not only broaden our basic understanding of mass spectrometry, but can also be utilized in practice. This will be illustrated giving several examples: Discussions on the ‘effective temparature’ (which facilitates obtaining thermochemical information); designing new experiments (to increase fragmentation of peptides and proteins); understanding mechanism of ionization techniques (and to help designing better ones); selecting between alternative reaction mechanisms; understanding fragmentation of macromolecules; and predicting fragmentation of peptides.


13

Paul Ewart – Optical diagnostics of moilecules with single mode and multi-mode lasers – No abstract available


14

NMR IN SOLID IONICS AND NANOIONICS

Detlef Brinkmann

Physik-Institut, University of Zürich,

CH-8057 Zürich, Switzerland

Nuclear Magnetic Resonance (NMR) is a spectroscopic technique which employs magnetic nuclei to study, among others, the dynamics of condensed matter at the atomic level. Thus, NMR has been and still is a successful instrument in the research field of solid electrolytes also known as solid ionics

This paper passes revue of typical NMR experiments performed in solid ionics together with some examples from nanoionics.. The experiments to be discussed comprise: (i) measurements of the diffusion coefficient employing the pulsed-field gradient and the static fringe-field method; (ii) the experimentally related NMR imaging; (iii) double resonance experiments like spin-echo double resonance (SEDOR) and two-dimensional Fourier transform NMR (2D-FT NMR); (iv) various types of nuclear relaxation, in particular spin-lattice relaxation

The NMR techniques yield information on topics like: type and number of mobile atoms and defects, diffusion pathways (e.g. dimensionality restrictions), atomic jump frequencies, activation energy and activation volume of these movements, diffusion coefficient with activation energy and prefactor, correlation effects in atomic movements, space correlation factor, cooperative phenomena, symmetry of atomic sites, behavior at phase transitions. These applications will be illustrated by giving examples from crystals, glasses, and polymers.


15

PHYSICAL PROPERTIES AND FUNCTIONALITY OF SILICON CARBIDE NANOPARTICLES AS ISOLATED OBJECTS OR STRUCTURED IN HYBRID

NANOCOMPOSITES

A.Kassiba1, J.Bouclé2, N.Errien1, M.Makowska-Janusik 3

1Laboratoire de Physique de l’Etat Condensé- UMR CNRS

6087 F-72085 Le Mans cedex 9/ France 2Optoelectronics Group, Cavendish Laboratory,

J.J.Thomson Av., Cambridge,UK 3Institute of Physics, University of Czestochowa,

Al.Armii.Krajowej, 13/15, 42-200 Czestochowa/ Poland The physical properties of functional hybrid nanocomposites were intensively investigated during the last decade. Among the reported functionalities, those in optics [1], electronics [2], photovoltaic [3] or optoelectronics [4] are very promising. As far as the functionalities are concerned, the active vectors consist in inorganic semiconducting nanocrystals. In this context, silicon carbide is a promising material due to its unique ability to adopt different crystalline polytypes which monitor the band gap and then the electronic and optical properties [5-7]. The SiC nanoparticles are characterized by versatile properties such dielectric behavior marked by interfacial polarizations [8-10] as well as the vibrational and luminescence properties which point out the main role of surface nature [6, 7]. Moreover, in hybrid materials based on inorganic nanocrystals, the interface effects between the organic and inorganic play a key role in the physical properties. So, an effective control of the surface states of the nanocrystals is an important challenge to tune the physical responses and their efficiency.

This lecture deals with some relevant properties of silicon carbide nanocrystals as isolated objects or associated with polymer matrices to realize functional materials for optics, electronics and electrooptics. The investigations developed on bare SiC nanocrystas consist in analyzing the physical properties including vibrational [7, 5], structural [10], dielectric [8, 9], as well as both linear and nonlinear optical behavior [6]. For all these studies, predictive numerical methods were developed in parallel by using ab-initio, molecular dynamics and quantum chemistry calculations to interpret and point out the main relevant parameters which govern the physical properties [6,7]. However, no valuable applications of these materials can be undertaken without the structuration of nanocrystals inside appropriate host matrices. Thus, polymer matrices were used for the evaluation of the potentialities of hybrid systems based on SiC nanocrystals and polymer in the area of electrooptics through the large pockels effects demonstrated in these media as well as the creation of suitable large area of organic-inorganic interfaces for charge transport and recombination for electroluminescence applications. An overview of the different nano-SiC based composite architectures and relevant properties will be discussed.


16

References [1] A.H.Yuwono, J .Xue, J .Wang, H. I .El im, W.J i , Y.Li and T.J .Whi te , J.Mater.Chem. 13 (2003) 1474 [2] K.R.Choudhury, J .G.Winiarz, M.Samoc, P .N.Prasad, Appl. Phys. lett. 82, 3 (2003) 406 [3] MMErwin, AV Kadavanich, J .McBr ide, T.Kippeny, S .Pennycook, S.J .Rosenthal , Eur.Phys. J.D, 16 (2001) 1 [4] J.Bouclé , A.Kassiba , M.Makowska-Janusik , N. Her l in-Boime, C. Reynaud, A. Desert , A. Bulou , J .Emery, J . Sanet ra , A. A. Pud , S. Kodjikian, Phys.Rev.B.74 (2006) 205417 [5] S.Charpent ier , A.Kassiba, A.Bulou, M.MOnth ioux, M.Cauche tier , Eur.Phy.J: Appl.Phy. 8(1999)111 [6] A.Kassiba, M.Makowska-Janus ik, J .Bouclé , J -F.Bardeau, A.Bulou, N.Herl in-Boime Phys.Rev.B. 66 (15) (2002) 155311 [7] M Makowska-Janusik , A Kassiba , J Bouclé , J -F Bardeau, S Kodjikian and A Déser t J. Phys.Cond.Mat.17 (2005) 5101 [8] A.Kassiba, M.Tabel lout , S.Charpentier , N.Herl in-Boime and J .R.Emery Solid.Stat.Com.115 (2000) 389 [9] M.Tabel lout , A.Kass iba, S.Tkaczyk, L.Laskowski , J .Swia tek J. Phys .Cond. Mat. 18 (2006)1143 [10] A.Kassiba in « Nanostructured Silicon based powders and composites »- Francis&Taylor (GB) – 2002


17

LOCAL MODES AND PHONONS AROUND PARAMAGNETIC

DEFECTS IN SOLIDS

Stanislaw K. Hoffmann

Institute of Mo;ecular Physics, Polish Academy of

Sciences, Smoluchowskiego 17, 60-179 Poznan, Poland

Defects introduced into crystalline materials can modify their static and dynamical properties and can be used as probes for studying local crystal properties. Question is if a defect participates in phonon motions of a host lattice or it has its own dynamics. If so, what is a coupling between defect motions and collective motions of the crystal lattice? These questions are important in doped semiconductors, and in solids where defects are generated for modification of physical properties. Phonon spectra are available for rather simple inorganic solids where they can be theoretically calculated or measured by neutron scattering technique. The phonon spectra usually deviate significantly from Debye-type phonon spectra presented in most of textbooks of solid-state physics. Vibrations of a simple defect appear in a narrow frequency range are called local mode. Because of a low defect concentration the local modes can be not detected by neutron scattering, but can be detected by classical spectroscopy methods. Local modes can be identified by Raman and IR spectroscopy when appear in the optical phonon branch region. Local modes appearing in acoustic phonon region are difficult to observation. They can be detected in studies of electron spin relaxation measured by pulsed electron paramagnetic resonance methods [1,2]. An electron spin system of paramagnetic defects relaxes, after a pulse excitation (in time order of micro- to milliseconds), to initial equilibrium transferring the excitation energy to phonons and/or to local mode of the defect. These two ways can be distinguished in pulsed EPR measurements in a broad temperature range. In the lecture a method of local mode detection with electron-spin echo will be described and results will be presented for paramagnetic ions doped into inorganic and organic solids and for free radicals generated by ionizing radiation in crystals. [1] J . Goslar , S. K. Hoffmann, W. Hi lczer , Local vibration mode mechanism of electron spin-lattice relaxation of PO3

2–-radicals in γ-irradiated (glycine)H3PO3 crystal,

Sol. State Comm. 121, 423-427 (2002). [2] S. K. Hoffmann, W. Hilczer , T. Radczyk, Electron spin-lattice relaxation in polymers and crystals related to disorder and structure defects. Acta Phys. Pol. A 103, 373-385 (2003).


18

CLASICAL AND QUANTUM ROTATION OBSERVED IN SMALL MOLECULAR GROUP BY NMR

Narcyz Piślewski

Institute of Molecular Physics Polish Academy of Sciences,

Poznan, Smoluchowskiego str. 17, Poland

The motions of particles across potential energy surfaces is ubiquitos to condensed mater physics and is manifest in chemical reactions in the chemical and biological sciences. Often, the characteristic rate for motion between the wells may by adequately described by an Arrhenius law in which case the particles are making classical barrier hopping. However, when the mass of the particles is small and the activation energy is low then the dynamics reveal the underlying quantum mechanical nature of the particles and the motion at low temperature may be dominated by tunneling. These are observed for symmetrical rotors (CH3, NH3, CH4, NH4 and deuterated ones) where coherent tunneling with a well-defined characteristic frequency gives rise to discrete features in the motional spectrum. In my presentation the proton spin-lattice relaxation times in natural and partially deuterated ammonium hexachlorotellurate will be described. At high temperature (above 50K) the relaxation curve reveals the classical, hindered reorientation of the ammonium ion with the same activation energy for all studied samples Ea = 5.6 kJ/mol. Below 50K, the minima which appear in the T1 temperature dependencies are related to the “level-crossing”. The tunneling splitting of the ground torsional level in isotopic pure ammonium hexachlorotellurate is equal to 55MHz and increases with increasing deuteron concentration. The lowest temperature minimum in isotopic pure (NH4)2TeCl6 powder can be interpreted as a result of the rigid ammonium ion’s classically reorientted about the threefold crystallographic axis. The “limited jumps” of NH4

+ are characterized by the angle ∆ = 4o between the NH bond and crystallographic [111] direction.


19

MIMICKING THE ANTENNA SYSTEM OF GREEN PLANTS

Gion Calzaferri

Department of Chemistry and Biochemistry, Freiestrasse

3, University of Bern, CH-3012 Bern, Switzerland;

www.dcb.unibe.ch/groups/calzaferri

Artificial photonic antenna systems have been realised by incorporating organic dyes in a microporous material.[1] We have been using zeolite L in most of our experiments as it has proven to be a very versatile host material. Zeolite L crystals are cylindrically shaped, porous aluminosilicates featuring a hexagonal symmetry. The size and aspect ratio of the crystallites can be tuned over a wide range. A nanometre sized crystal consists of many thousand one dimensional channels oriented parallel to the cylinder axis. These can be filled with suitable organic guests. Geometrical constrains of the hosts framework lead to supra¬molecular organisation of the guests in the channels. Thus very high concentrations of monomeric dye molecules can be realized. A special twist is added to these systems by plugging the channel openings with a second type of fluorescent dye, which we call stopcock molecule. The two types of molecules are precisely tuned to each other; the stopcocks are able to accept excitation energy from the dyes inside the channel, but cannot pass it back.[2] The supramolecular organization of dyes inside the zeolite channels is what we call the first stage of organization. It allows light harvesting within the volume of a dye-loaded zeolite L crystal and also radiationless energy transport to either the cylinder ends or centre. The second stage of organization represents the coupling to an external acceptor or donor stopcock fluorophore at the ends of the zeolite L channels, which can then trap or inject electronic excitation energy. The third stage of organization is realised by interfacing the material to an external device via a stopcock intermediate. We recently observed that electronic excitation energy transfer in dye-zeolite L materials occurs along a well specified axis.[3] This important finding means that organized, uni-directional materials can be prepared. In order to achieve this, we prepared zeolite L monolayers, filled them with luminescent dyes, and finally added a stopcock. These procedures and their repercussions on the design of novel materials will be discussed.[4], [5] [1] G. Calzaferr i , S. Huber , H. Maas, C. Minkowski Photon-Harvesting Host-

Guest Antenna Materials, , Angew. Chem. Int. Ed. 42, 2003, 3732. [2] H.Maas, G. Calzaferr i Trapping Energy from and Injecting Energy into Dye-

Zeolite Nanoantennae, Angew. Chem. Int. Ed. 41, 2002, 2284-2287. S. Huber, G. Calzaferr i , Sequential Functionalization of the Channel Entrances of Zeolite L Crystals, Angew. Chem. Int. Ed. 43, 2004, 6738-6742.

[3] C. Minkowski, G. Calzaferr i , Förster-Type Energy Transfer along a Specified Axis

Angew. Chem. Int. Ed. 44, 2005, 5325.


20

[4]a) A. Zabala Ruiz, H. Li, G. Calzaferr i , Organizing supramolecular functional dye-zeolite crystals , Angew. Chem. Int. Ed. 45, 2006, 5282.

b) S. Huber, A.Zabala Ruiz, H. Li, G. Patr inoiu, Ch. Botta , G. Calzaferr i Optical spectroscopy of inorganic-organic host-guest nanocrystals organized as oriented monolayers, Inorg. Chim. Acta 360, 2007, 869-875

[5]a) S. Suárez, A. Devaux, J . Bañnuelos, O. Bossart, A. Kunzmann, G. Calzaferr i Transparent Zeolite-Polymer Hybrid Materials with Tunable Properties, Adv. Func. Mater, 2007, in press


21

ISOTOPE EFFECTS IN ELECTRON EXCHANGE REACTIONS OF LANTHANIDE AND ACTINIDE ELEMENTS INCLUDING CHEMICAL URANIUM ENRICHMENT Yasuhiko Fujii,1) Masao Nomura,1) Tatsuya Suzuki,1) and Damian Axente2)

1) Research Laboratory for Nuclear Reactors, Tokyo

Institute of Technology, O-okayama, Meguroku, Tokyo

152-8550 Japan

2) Institute for Research and Development of Isotopic and

Molecular Technologies, 3400 Cluj-Napoca, P. O. Box

700, Romania

Isotope separation by chemical exchange is very popular for light elements, such as hydrogen, lithium, boron, carbon, nitrogen and oxygen. Due to the mass dependence of the isotope effects, the chemical exchange was considered not to be applicable to uranium enrichment. However uranium enrichment processes by ion exchange and solvent extraction have been developed in Japan and France, respectively. The principle of the chemical uranium enrichment was not known for many years. It was clarified 10 yeas ago that the origin of the uranium isotope effects was not in the molecular vibration but in the electron-nucleus interaction. Since then, attention has been placed on the similarities between the isotope effects in chemical exchange reactions and the isotope shifts in atomic emission spectra. Study on the temperature dependence of the isotope separation factor was a key to separate the “electron effects” and “molecular effects”. In the present paper, experimental work on gadolinium isotope effects in amalgamation is presented and isotope effects of lanthanide elements and actinide elements are reviewed. Discussion is extended to the role and effects of “ f ” electrons of these elements. Non-proliferation is the most serious problem in nuclear technology development. The chemical exchange uranium enrichment has been regarded as the proliferation-resistant technologies. Chemical enrichment, of which development has been abandoned in Japan and France, could be reconsidered again among international nuclear technology communities. [1] Masao Nomura , Nobuhiko Higuchi, Yasuhiko Fuj i i , “Mass Dependence of Uranium Isotope Effects in the U(IV)-U(VI) Exchange Reaction”, J. Am. Chem. Soc., 118, 9127 (1996). [2] J . Bigeleisen, ” Nuclear Size and Shape Effects in Chemical Reactions. Isotope Chemistry of the Heavy Elements ” J. Am. Chem. Soc. 118, 3676 (1996). [3] Ibrahim Ismai l , Masao Nomura , Yasuhiko Fuj i i , “ Isotope Effects in Eu (II)/Eu(III) Electron Exchange System Observed by Using Cation Exchange

Chromatography” J. Nucl. Sci. Technol. 35, 801 (1998). [4] Yasuhiko Fuji i , Masao Nomura, Yasutoshi Ban, “ Isotope Effects in Electron Exchange Reactions”, J. Nucl. Sci. Technol. 39, 413 (2002).


22

SEPARATION OF TRIVALENT MINOR ACTINIDES FROM LANTHANIDES BY THERMOSENSITIVE GELS INTRODUCING FUNCTIONAL LIGAND

Kenji Takeshita

Chemical Resources Laboratory, Tokyo Institute of Technology

4259 Nagatsuta, Midori-ku, Yokohama 226-8502, Japan

Solvent extraction technique is applicable widely to the nuclear wastes

treatment, for example the reprocessing of spent nuclear fuel and the recovery of long-lived nuclides from the high-level liquid wastes. However, large amounts of secondary wastes are generated by the operation of these solvent extraction processes. Recently, we proposed a new zero-emission separation process using thermosensitive gel instead of solvent extraction process, which is applicable to the partitioning and transmutation (P&T) system of trivalent MAs (minor actinides) in HLW (high-level wastes). Functional ligands are introduced in the polymer network of thermosensitive gel. A thermosensitive polymer gel is shrunken above LCST (Lower critical solution temperature) and swollen below LCST. Such volume change of thermosensitive gel is well known as the volume phase transition phenomena. Then, the complex formation of specific metal ion is controlled by the structural change of functional ligand with the volume phase transition of thermosensitive gel. The selective extraction of object metal is done by the thermal-swing operation and then no chemicals are required for elution. Secondary wastes are not generated principally from the thermal-swing extraction process.

Firstly, the authors synthesized some thermosensitive NIPA (N-isopropylacrylamide) gels with a phosphoric acid ester and a BTP (2,6-di(3-vinylbenzyl-1,2,4-triazol-5-yl)pyridine) as functional ligands and tested the thermal-swing extraction of heavy metals, such as lanthanide, actinide and transient elements. The object metals were recovered successfully by these gels, but the difference in the distribution ratios of these metals between the swelling state and the shrinking one of gel was less than 5 times. The further increase in the difference of distribution ratios is required for the establishment of practical process.

Recently, the separation of trivalent minor actinides (MAs) from lanthanides was investigated by a thermosensitive NIPA gel introducing a hexadentate ligand, TPEN (N,N,N',N'-tetrakis(2-pyridylmethyl)ethylenediamine) derivative. The obtained gel showed clear thermosensitivity with the volume phase transition at 34°C. The separation of a trivalent MA, Am(III), from a lanthanide, Eu(III), was observed in the swelling state of gel (5°C) and the separation factor of Am(III) was evaluated as about 18 at pH5.2. The distribution ratio of Am(III) was reduced to about 1/8 by the volume phase transition from the swelling state (5°C) to the shrinking one (40°C). These results suggest that Am(III) can be separated and recovered effectively from Eu(III) in aqueous nitrite solution without the generation of secondary wastes under the thermal-swing extraction operation using the thermosensitive gel.


23

SIMPLIFIED CALCULATION METHOD OF DEUTERIUM SEPARATION FACTOR BETWEEN HYDROGEN AND WATER (αH/D)

DEPENDING ON D-ATOM FRACTION OF LIQUID WATER

Masami Shimizu*1, Kenji Takeshita2

1. Isotope Science Laboratory,

1198 Isshiki, Hayama, Kanagawa 240-0111, Japan

2. Chemical Resources Laboratory, Tokyo Institute of

Technology, 4259 Nagatsuta, Midori-ku, Yokohama 226-

8503, Japan

By means of the published equilibrium constants of the following hydrogen isotopic reactions,

)v(HDO)g(H)v(OH)g(HD 22 +←

→+

[ ] [ ][ ] [ ]

++−==2

v2g

vg21 T

2380

T

2.4492735.0exp

OHHD

HDOHK

)g(HD2)g(D)g(H 22 ←

→+

[ ][ ] [ ]

−−==2

g2g2

2g

2 T

3485

T

545.283726.1exp

DH

HDK

)v(HDO2)v(OD)v(OH 22 ←

→+

[ ][ ] [ ]

+−==

2v2v2

2v

3 T

0.4133

T

412.544699.1exp

ODOH

HDOK

)l(HDO)v(OH)l(OH)v(HDO 22 +←

→+

[ ] [ ][ ] [ ]

+−==2

2v

v24 T

25490

T

3.800592.0exp

OHHDO

HDOOHK

l

l

)l(HDO2)l(OD)l(OH 22 ←

→+ [ ]

[ ] [ ]

−−==

222

2

5 T

3409

T

7317.73989.1exp

ODOH

HDOK

ll

l

both the separation factor between water vapor and liquid water, αl, and that between hydrogen gas and water vapor, αg, were derived as follows

( )( )( )( )5435

5443

KR2KKKR2

KRK21R2KK)]z1/(z[)]x1/(x[

ll

ll

l ++

++=−−=α

( )( )( )( )4215543

54143521g KKKKR2KRK2K

KRKK2KKKR2KK)]y1/(y[)]z1/(z[

++

++

abstractsmaria mihet, mihaela lazar, ovidiu ardelean, monica dan, valer almasan - h/d isotopic...

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