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Based on the path integral representation of the partition function of a many body system with separable two body interaction we propose a systematic extension of the perturbed static path approximation (PSPA) to lower temperatures.…

Statistical Mechanics · Physics 2009-11-07 Christian Rummel , Joachim Ankerhold

LibRPA is a software package designed for efficient calculations of random phase approximation (RPA) electron correlation energies from first principles using numerical atomic orbital (NAOs). Leveraging a localized resolution of identity…

Materials Science · Physics 2024-07-30 Rong Shi , Min-Ye Zhang , Peize Lin , Lixin He , Xinguo Ren

We present a family of \textit{Gaussian Mixture Approximation} (GMA) samplers for sampling unnormalised target densities, encompassing \textit{weights-only GMA} (W-GMA), \textit{Laplace Mixture Approximation} (LMA),…

Machine Learning · Computer Science 2025-10-01 Yongchao Huang

The ground-state correlation energy calculated in the random-phase approximation (RPA) is known to be identical to that calculated using a subset of terms appearing in coupled-cluster theory with double excitations. In particular, this…

Chemical Physics · Physics 2019-04-16 Timothy C. Berkelbach

The self-consistent quasiparticle random-phase approximation (QRPA) approach is formulated in the canonical single-nucleon basis of the relativistic Hatree-Fock-Bogoliubov (RHFB) theory. This approach is applied to study the isobaric analog…

Nuclear Theory · Physics 2017-04-12 Z. M. Niu , Y. F. Niu , H. Z. Liang , W. H. Long , J. Meng

Nuclear physics is ideal to test and develop techniques to describe the microscopic dynamics of quantum many-body systems. At low energy, nuclear dynamics is described with non-relativistic approaches based on the mean-field approximation…

Nuclear Theory · Physics 2023-02-10 Cedric Simenel

In this paper we develop non-asymptotic Gaussian approximation results for the sampling distribution of suprema of empirical processes when the indexing function class $\mathcal{F}_n$ varies with the sample size $n$ and may not be Donsker.…

Statistics Theory · Mathematics 2023-09-06 Alexander Giessing

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…

A nonlinear description of the interaction of charged particles penetrating a solid has become of basic importance in the interpretation of a variety of physical phenomena. Here we develop a many-body theoretical approach to the quadratic…

Materials Science · Physics 2009-10-31 T. del Rio Gaztelurrutia , J. M. Pitarke

A microscopic formalism is developed that includes the coupling to two particle-hole phonons in the particle-hole propagator by extending the dressed random phase approximation (DRPA) equation for a finite system. The resulting formalism is…

Nuclear Theory · Physics 2016-09-08 C. Barbieri , W. H. Dickhoff

We present an extension of the random--phase approximation (RPA) where the RPA phonons are used as building blocks to construct the excited states. In our model, that we call double RPA (DRPA), we include up to two RPA phonons. This is an…

Nuclear Theory · Physics 2016-02-17 D. Gambacurta , F. Catara , M. Grasso , M. Sambataro , M. V. Andrés , E. G. Lanza

We present an efficient implementation of the random phase approximation (RPA) for molecular systems within the domain-based local pair natural orbital (DLPNO) framework. With optimized parameters, DLPNO-RPA achieves approximately 99.9%…

Chemical Physics · Physics 2025-08-18 Yu Hsuan Liang , Xing Zhang , Garnet Kin-Lic Chan , Timothy C. Berkelbach , Hong-Zhou Ye

A new theoretical approach to 1:1 electrolytes at low temperature is developed, RPM and SAPM are studied with this approach, and their critical points of first order phase transition are calculated. The result is in very good agreement with…

Soft Condensed Matter · Physics 2007-05-23 Weimin Zhou , Jerome K. Percus

We detail our implementation of the random-phase-approximation based functional (RPAF) derived in our previous publication [Phys. Rev. B 110, 195151 (2024)] for the QUANTUM ESPRESSO (QE) package. We also make available the source files…

Materials Science · Physics 2025-04-02 Angel Rosado , Mario Benites , Efstratios Manousakis

We develop and implement a formalism which enables calculating the analytical gradients of particle-hole random-phase approximation (RPA) ground-state energy with respect to the atomic positions within the atomic orbital basis set…

Chemical Physics · Physics 2021-09-03 Muhammad N. Tahir , Tong Zhu , Honghui Shang , Jia Li , Volker Blum , Xinguo Ren

In this work, we address the question of calculating the local effective Coulomb interaction matrix in materials with strong electronic Coulomb interactions from first principles. To this purpose, we implement the constrained random phase…

Strongly Correlated Electrons · Physics 2012-10-22 Loig Vaugier , Hong Jiang , Silke Biermann

We show that the correlations of the quasiparticle random-phase approximation (QRPA) significantly reduce the nuclear matrix element (NME) of neutrinoless double-beta decay by a new mechanism in the calculation for $^{150}$Nd $\rightarrow$…

Nuclear Theory · Physics 2015-03-18 J. Terasaki

We have investigated the phase transition of the gas-liquid type, with an upper critical point, in a variant of the One Component Plasma model (OCP) that has a uniform but compressible compensating background. We have calculated the…

Plasma Physics · Physics 2009-03-27 Igor Iosilevskiy

In a recent article [Phys. Rev. B 90, 125102 (2014)] we showed that the random phase approximation with exchange (RPAx) gives accurate total energies for a diverse set of systems including the high and low density regime of the homogeneous…

Strongly Correlated Electrons · Physics 2016-05-11 Nicola Colonna , Maria Hellgren , Stefano de Gironcoli

The nucleation rates derived for the condensation from a supersaturated vapor are examined both in the classical theory and in the modern coarse-grained field theory. By virtue of the scaling variable $\lambda_Z$ it is shown that the method…

Disordered Systems and Neural Networks · Physics 2009-10-31 Larissa V. Bravina , Eugene E. Zabrodin