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[5] N. Quang Hung and N. Dinh Dang, in preparation
 
[5] N. Quang Hung and N. Dinh Dang, in preparation
  
== '''The two faces of RPA : density functional theory and many-body perturbation theory''' ==
+
== '''The two faces of RPA: density functional theory and many-body perturbation theory''' ==
  
 
'''Xavier Gonze'''
 
'''Xavier Gonze'''

Version du 5 décembre 2009 à 17:26

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The Selfconsistent Quasiparticle RPA and Its Description of Thermal Pairing Properties in Nuclei

Nguyen Dinh Dang

1 - Heavy-Ion Nuclear Physics Laboratory, Nishina Center for Accelerator-Based Science RIKEN 2-1 Hirosawa, Wako city, 351-0198 Saitama, Japan

2 - Institute for Nuclear Science and Techniques, Vietnam Atomic Energy Commission Hanoi - Vietnam

The Selfconsistent Quasiparticle RPA (SCQRPA) is constructed [1] to study the effects of fluctuations on pairing properties in finite systems. The theory is applied to nuclei at finite temperature [2] and angular momentum [3]. Particle number projection is taken into account within the Lipkin-Nogami method. Several issues such as the smoothing of superfluid-normal phase transition, thermally assisted pairing in hot rotating nuclei, extraction of the nuclear pairing gap using an improved odd-even mass difference are discussed [4]. Finally, a novel approach of embedding the projected SCQRPA eigenvalues in the canonical ensemble (CE) is proposed (the CE-SCQRPA) [5]. Applied to a doubly-folded equidistant multilevel pairing model, the proposed CE-SCQRPA produces results in good agreement with those obtained by using the exact eigenvalues, whenever the latter are possible, and is workable also for large values of particle number (N>14), where the diagonalisation of the pairing Hamiltonian is impracticable.

References

[1] N. Quang Hung and N. Dinh Dang, 
Phys. Rev. C 76 (2007) 054302 and 77 (2008) 029905(E).

[2] N. Dinh Dang and N. Quang Hung, 
Phys. Rev. C 77 (2008) 064315.

[3] N. Quang Hung and N. Dinh Dang, 
Phys. Rev. C 78 (2008) 064315.

[4] N. Quang Hung and N. Dinh Dang, 
Phys. Rev. C 79 (2009) 054328.

[5] N. Quang Hung and N. Dinh Dang, in preparation

The two faces of RPA: density functional theory and many-body perturbation theory

Xavier Gonze

Unité Physico-Chimie et de Physique des Matériaux (PCPM), Université catholique de Louvain, Place Croix du Sud 1, B-1348 Louvain-la-Neuve, Belgique

The RPA expression for total energy might be derived either within density functional theory, (in the adiabatic-connection fluctuation-dissipation framework, by setting the exchange-correlation kernel to zero), or from many-body perturbation theory (from the Nozières functional in the GW approximation for the self-energy, when the green's function corresponds to an energy-independent one-body Hamiltonian). I will review results in which these two faces of RPA appear. First, the RPA exchange-correlation potential is obtained from a linear-response Sham-Schlüter equation [1,2]. Second, the RPA band gap (I-A expression) corresponds to non-renormalized G_0 W_0 [3]. I will also show that density functional theory within the RPA provides a correct description of bond dissociation for the hydrogen dimer in a spin-restricted Kohn-Sham formalism, i.e., without artificial symmetry breaking, with important static (left-right) correlation [4]. Although exact at infinite separation and accurate near the equilibrium bond length [5], the RPA dissociation curve displays unphysical repulsion at larger but finite bond lengths [4,6].

References

[1] Y.-M. Niquet, M. Fuchs, X. Gonze, J. Chem. Phys. 118, 9504 (2003)

[2] Y.-M. Niquet, M. Fuchs, X. Gonze, Phys. Rev. A 68, 032507 (2003)

[3] Y.-M. Niquet, X. Gonze, Phys. Rev. B 70, 245115 (2004)

[4] M. Fuchs, Y.-M. Niquet, X. Gonze, K. Burke, J. Chem. Phys. 122, 094116 (2005)

[5] M. Fuchs, X. Gonze, Phys. Rev. B 65, 235109 (2002)

[6] M. Fuchs, K. Burke, Y.-M. Niquet, X. Gonze, Phys. Rev. Lett. 90, 189701 (2003)

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