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The relative energies of different phases or polymorphs of molecular solids can be small, less than a kiloJoule/mol. Reliable description of such energy differences requires high quality treatment of electron correlations, typically beyond…

Chemical Physics · Physics 2024-02-19 Khanh Ngoc Pham , Marcin Modrzejewski , Jiří Klimeš

We present a technique which allows us to solve the Random Phase Approximation equations with finite-range interactions and treats the continuum part of the excitation spectrum without approximations. The interaction used in the…

Nuclear Theory · Physics 2011-05-13 V. De Donno , G. Co' , M. Anguiano , A. M. Lallena

Low-rank approximation of a matrix by means of random sampling has been consistently efficient in its empirical studies by many scientists who applied it with various sparse and structured multipliers, but adequate formal support for this…

Numerical Analysis · Mathematics 2016-06-07 Victor Y. Pan , Liang Zhao

The connections between the Random Phase Approximation (RPA) and Many-Body Perturbation Theory (MBPT) and its all order generalisation, the Coupled- Cluster Theory (CCT) have been explored. Explicit expressions have been derived for the…

The optimized effective potential (OEP) method presents an unambiguous way to construct the Kohn-Sham potential corresponding to a given diagrammatic approximation for the exchange-correlation functional. The OEP from the random-phase…

Materials Science · Physics 2023-07-18 Stefan Riemelmoser , Merzuk Kaltak , Georg Kresse

The action of the long-range residual force on the expectation value of observables in the nuclear ground states is evaluated by finding optimal values for the coefficients of the canonical transformation which connects the phonon vacuum…

Nuclear Theory · Physics 2015-06-12 S. Mishev

It is well known that within self-consistent Random Phase Approximation (RPA) on top of Hartree-Fock (HF), the translational symmetry should be restored. Due to approximations at the level of the practical implementation, this restoration…

Nuclear Theory · Physics 2012-09-24 Kazuhito Mizuyama , Gianluca Colò

Spin-isospin transitions in nuclei away from the valley of stability are essential for the description of astrophysically relevant weak interaction processes. While they remain mainly beyond the reach of experiment, theoretical modeling…

Nuclear Theory · Physics 2021-06-16 D. Vale , Y. F. Niu , N. Paar

Linear response theory is a well-established method in physics and chemistry for exploring excitations of many-body systems. In particular, the quasiparticle random-phase approximation (QRPA) provides a powerful microscopic framework by…

Computational Physics · Physics 2025-10-17 L. Jin , A. Ravlić , P. Giuliani , K. Godbey , W. Nazarewicz

We recently introduced an efficient methodology to perform density-corrected Hartree-Fock density functional theory (DC(HF)-DFT) calculations and an extension to it we called "corrected" HF DFT (C(HF)-DFT). In this work, we take a further…

Chemical Physics · Physics 2023-11-10 Daniel Graf , Alex J. W. Thom

Range-separated methods combining a short-range density functional with long-range random phase approximations RPAs with or without exchange response kernel are tested on rare-gas dimers and the S22 benchmark set of weakly interacting…

Chemical Physics · Physics 2014-04-10 Wuming Zhu , Julien Toulouse , Andreas Savin , János G. Angyán

A self-consistent Quasiparticle-Random-Phase-Approximation (QRPA) model which employs the canonical Hartree-Fock-Bogoliubov (HFB) basis and an energy-density functional with a Skyrme mean field part and a density-dependent pairing, is used…

Nuclear Theory · Physics 2008-12-24 Jun Li , Gianluca Colo' , Jie Meng

Recent studies have shown that concepts of effective field theory such as naturalness can be profitably applied to relativistic mean-field models of nuclei. Here the analysis by Friar, Madland, and Lynn of naturalness in a relativistic…

Nuclear Theory · Physics 2008-11-26 R. J. Furnstahl , John J. Rusnak

The Hartree-Fock approximation to the many-fermion problem can break exact symmetries, and in some cases by changing a parameter in the interaction one can drive the Hartree-Fock minimum from a symmetry-breaking state to a…

Nuclear Theory · Physics 2009-09-11 Calvin W. Johnson , Ionel Stetcu

Systems of interacting random replicators are studied using generating functional techniques. While replica analyses of such models are limited to systems with symmetric couplings, dynamical approaches as presented here allow specifically…

Disordered Systems and Neural Networks · Physics 2009-11-11 Tobias Galla

We assess the performance of a recently proposed renormalized adiabatic local density approximation (rALDA) for \textit{ab initio} calculations of electronic correlation energies in solids and molecules. The method is an extension of the…

Materials Science · Physics 2014-05-30 Thomas Olsen , Kristian S. Thygesen

We derive the self-consistent random phase approximations (sc-RPA) from the projective truncation approximation (PTA) for the equation of motion of two-time Green's function. The obtained sc-RPA applies to arbitrary temperature and recovers…

Strongly Correlated Electrons · Physics 2026-04-21 Yue-Hong Wu , Xinguo Ren , Ning-Hua Tong

The accuracy of the constrained random phase approximation(cRPA) method is examined in multi-orbital Hubbard models containing all possible on-site density-density interactions. Using DMFT, we show that the effective model constructed using…

Strongly Correlated Electrons · Physics 2018-10-16 Qiang Han , B. Chakrabarti , K. Haule

Liquid-liquid phase separation underlies phenomena ranging from protein condensate formation to the phase coexistence of synthetic polymers. Although the random phase approximation (RPA) is widely used to predict such phase behavior, its…

Soft Condensed Matter · Physics 2026-05-05 Kiyoharu Kawana , Kyosuke Adachi

The random-phase approximation has been used to compute the properties of parabolic two-dimensional quantum dots beyond the mean-field approximation. Special emphasis is put on the ground state correlation energy, the symmetry restoration…

Mesoscale and Nanoscale Physics · Physics 2009-02-06 Llorens Serra , Rashid G. Nazmitdinov , A. Puente