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6/25/2015 Fedor Simkovic 1 III. Quasiparticle Random Phase Approximation: Formalism Fedor Šimkovic JINR Dubna, Comenius University, Bratislava Gran Sasso, November 11-13, 2010 International Student Workshop on “Neutrinoless Double Beta Decay”

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Page 1: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

6/25/2015 Fedor Simkovic 1

III. Quasiparticle Random Phase Approximation: Formalism

Fedor Šimkovic

JINR Dubna,Comenius University, Bratislava

Gran Sasso, November 11-13, 2010 International Student Workshop on“Neutrinoless Double Beta Decay”

Page 2: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

6/25/2015 Fedor Simkovic 2

0-decay matrix element(two ways of calculation)

Page 3: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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0-decay matrix elements

Weak hadron current

Weak hadron current in a Breit frame

Formfactor

Page 4: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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Two one-body operators

K=VV, MM, AA, PP, AP

Product of one-bodymatrix elements

Decomposition ofplane waves

One-body operator

Page 5: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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One two-body operators

Neutrino potential

Nuclear matrix element

Integration overangular part of

momentum

Page 6: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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Calculation of two-body matrix elementsFrom j-j to LS

coupling

Moshinsky transformation

to relative coordinates

Two-bodym.e.

Page 7: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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Many-body wave functions

Page 8: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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Many-body Hamiltonian

• Start with the many-body Hamiltonian

• Introduce a mean-field U to yield basis

• The mean field determines the shell structure• In effect, nuclear-structure calculations rely on perturbation theory

H p i

2

2mi

VNN

r i

r j

i j

0s N=0

0d1s N=2

0f1p N=4

1p N=1

H p i

2

2mU ri

i

VNN

r i

r j

i j

U ri i

Residual interaction

The success of any nuclear structure calculation depends on the choice of the mean-field basis and the residual interaction!

Page 9: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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Goeppert-Mayer and Haxel,Jensen, and Suess proposedthe independent-particleshell model to explainthe magic numbers2, 8, 20, 28, 50, 82, 126, 184

Shell structure of spherical nucleus

2

40

20

70

112

8

168

M.G. Mayer and J.H.D. Jensen, Elementary Theory of Nuclear Shell Structure,p. 58, Wiley, New York, 1955

Harmonic oscillator with spin-orbit is a

reasonable approximation to the nuclear

mean field

s, p, d, f, g, h, il = 0, 1, 2, 3, 4, 5, 6

Page 10: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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Nuclear many-body wave functionSingle nucleon state

Two-nucleon state (nucleons are fermions)

Slater determinat

Ground state ofA-nucleons system

Page 11: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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Second quantization

Creation and annihilation operators

Anticommutators

Ground state ofA-nucleons system

One-body operator

Two -body operator

Nuclear Hamiltonian

Page 12: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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BCS approximationPairing interaction is strongly attractive. This force acts between like nucleonsin the same single particle orbit. It induces the two nucleons to couple with J=0

Two-particle state:

Ansatz for ground state with pairing correlations

The BCS g.s. is a superposition of states

with different numbers of nucleons

The particle number is not conserved

Page 13: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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The normalization of the BCS ground state to unity requires:

Occupation probability

The number operator in a singleparticle orbit j The number of particles

in the single particle orbit

Page 14: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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BCS equation

When the Hamiltonian of system is provided, the occupation amplitudesare determined by energy variation

The BCS ground state is expressed by considering p and n degreesOf freedom

Variation with a constraint thatexpectation value of number operators

should be equal to particle number

The modified Hamiltonian for variation

Page 15: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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u and v are not independent.they are constrained by anormalization condition

Variation is explicitly written as

The nuclear Hamiltonian

BCS expectation value

Page 16: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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Performing the variation

We obtain a set of BCS equation

We get quadratic equation for v2

Solution for BCS amplitudes:

Page 17: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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BCS algoritmus

Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis

Calculate:

Give also trial values of occupation amplitudes and chemical potentials

Step 1: Calculate proton and neutron pairing gaps:

Page 18: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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Step 2:

Step 3:

Step 4:

Calculate occupationAmplitudes:

Calculate expectation values of thenumber of protons and neutrons

with occupation amplitudes, whichare evaluated in previous step

Compare the proton and neutron numbers in the previous step and those of the nuclear under consideration. If they agree within

a certain small number, the iterative calculation is converged.if not, the chemical potentials are slightly changed. A larger chemical

potential results in a larger nucleon number. We then go back to Step 1and the iterative processes from Step 1 through Step 5 are repeated

again.

Page 19: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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Qusiparticles – Bogoliubov transforamtionCreation and annihilationoperators of quasiparticles:

Anticommutation relations for q.p. operators calculated by using those

of particle operators

Notation:Unitary transformations between

particles and quasiparticles

Page 20: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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BCS equation (from equation of motion)BCS equation:

Quasiparticle Energy:

Pairing gap (renormalization of pairing int.):

Diagonalization:Solution:

Experimental pairing gaps:

Mass formula:

Page 21: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

6/25/2015 Fedor Simkovic 21

Qusiparticle Random Phase Approximation(General formalism)

Page 22: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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Quasiparticle RPA ModelsEquation of motion

The correlated ground state: |rpa>

Excited states are constructed onthe RPA g.s. by a set of operators:

Equation of motion for operator Q+

The RPA ground state is the vacuum for the set of operators

Page 23: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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Equation of motion

Instead of operator equation,we consider expectation value

equation

Rewritten with commutators

Vanishing of matrix elements

The equation of motion has been derived without any approximation,from only the eigenvalue equation

Page 24: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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Assumption on excitation operators

We assume that the excitation operators are expressed by a sum of two-quasiparticle creation and annihilation operators

creates a proton-neutronquasiparticle pair

correspondingannihilation operator

The Hermitian conjugate are

This is a spherical tensorof rank-J

and its projection M

Page 25: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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QRPA equations

Equation of motion is described in a basis of proton-neutron pairs pnOperator between RPA ground state has to be a sclar

substituing

Moreexplicitely

we get

Page 26: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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we take the advantage of relations

QRPA equations in matrix form

Elements of submatrices A, B and C are

Rows of the matrices X and Y are labeled by pn-pairs, while columns of themby eigenvalues . That is Xij represents the i-th component of the forward-goingamplitude of j-th eigenstate. Excitations energies and amplitudes are obtainedby solving QRPA equations. When number of pn-pairs is n in the model space for a given angular momentum J, submatrices A, B and C are nxn matrices

Page 27: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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Qrthonormality of excited statesThe excited states, which are eigenstates of Hamiltonian H, are orthogonal

To one another, and are normalized to unity:

With explicit form

the commutator is evaluated as

Page 28: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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with help of

The orthonormality condition is expressed as

In matrix form

Eigenstates are thus orthonormalized not by amplitudes themselves,but with overlap matrix C

Page 29: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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Overlap matrixElements of overlap matrix are defined by expectation values of the commutator

commutator is written as

The commutator for creation and annihilation operators is

Page 30: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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is number operator for the quasiparticle jp orbit

Matrix elements of the overlap matrix are

j is the occupation probability of the quasiparticle j-orbit

Page 31: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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Quasiparticle HamiltonianHamiltonian in particle representation

BCS transformation

Normal product

Page 32: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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Hamiltonian in quasi-particlerepresentation

two-quasiparticleoperators

Page 33: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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QRPA matrices

Definition:

Solution of BCS equation: Ep, En, up, vp, un, vnG-matrix elements of realistic NN interaction

p, n not yet determined

Calculated:

For numericalcalculationwe need:

Page 34: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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Standard QRPARenormalized QRPA

Selfconsistent Renormalized QRPA

Page 35: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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Standard QRPA

Quasibosonapproximation:

QRPA equation:

RPA matrices:

gpp – renormalization of particle-particle NN interactiongph – renormalization of particle-hole NN interaction

Page 36: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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Operator changing neutron to proton:

Transition amplitude to excited state

proton particle – neutron hole operatorrewritten with quasiparticles

One-body density within the QRPA:

Page 37: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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Diagonalization of the QRPA equation

QRPA equation:

Cholesky decomposition:

Standard eigenvalueproblem:

QRPA amplitudes

Page 38: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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Renormalized QRPA

Defining scaled submatricesand scaled amplitudes

Using the diagonal matrix D , the RPA equation can be written as

Diagonal elements of theoverlap matrix can be usedto scale various quantities

Renormalized QBA:

Page 39: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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The well-known form of RPA matrix equation

The excitation operatorsand their hermitian

conjugates:

Inverse relations:

Gamow-Teller transition amplitudes writtenwith scaled amplitudes and scaling factors:

Page 40: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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QRPA ground state wave functionThe RPA g.s. wave function is connected by a canonical transformation

to quasiparticle ground state

Coefficients Z are evaluated by using the factthat the ground state is the vaccum for excitations operators

Page 41: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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Occupation probabilities of quasiparticle states

Occupation probabilitiesof proton and neutron quasiparticle orbits

Occupation probability(matrix element of number op.)

Page 42: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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QRPA-like aproaches(QRPA, RQRPA, SRQRPA)

Z=<BCS|Z|BCS>

Particle number condition

i) Uncorrelated BCS ground state

Pauli exclusion principle

i) violated (QBA)

[A,A+] =<BCS|[A,A+]|BCS>

QRPA, RQRPA QRPA

ii) Correlated RPA ground state

Z=<RPA|Z|RPA>

SRQRPA

ii) Partially restored (RQBA)

[A,A+] =<RPA|[A,A+]|RPA>

RQRPA, SRQRPA

Complex numerical procedureBCS and QRPA equations are coupled

N=<BCS|N|BCS>

N=<BCS|N|BCS>

Page 43: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

6/25/2015 Fedor Simkovic 43

Overlap factor – Two QRPA diagonalizations

Two sets of states

Phonon operators

Unitary transformationbetween quasiparticles

Page 44: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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By neglecting scattering terms

With help of above expresion

Frequently considered overlap factor of two sets of states

second term neglected

Page 45: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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For spherical nuclei BCS overlap about 0.8For deformed nuclei might be smaller

=> Can not be neglected!

BCS overlap of intial and final states

Page 46: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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Instead of Conclusions

We are atthe beginningof the Road…

The future of neutrino physics is bright.

Page 47: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

August 2013 47 4747

The World NeutrinoExperimental Program

Parameter Measurement23 Octant (>, < 45)Mass hierarchyMass scaleCP violation Dirac or Majorana?More accuracy for 12, 23, 13, m

32, m221

Questions with answers

Paradigm testing Sterile neutrinos?Non standard Interactions?

Lorentz violation?CPT violation?Non‐Unitarity of PMNS matrix?

Questions which might or might not have answers

Page 48: III. Quasiparticle Random Phase Approximation: Formalism · BCS algoritmus Step 0: Give single-particle energies for p and n, two-body matrix elements in the nucleon basis Calculate:

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Neutrino physics is BabylonianMathematics is Egyptian

The truth is covered in experiments.

Like most people, physicists enjoy a good mystery.

When you start investigating a mystery you rarely know where it is going

Thanks to neutrinos we understand Sun, Supernova, Earth (nuclear reactions)