Exact and approximate adiabatic connection formulae for the correlation energy in multireference ground and excited states
出版年份 2018 全文链接
标题
Exact and approximate adiabatic connection formulae for the correlation energy in multireference ground and excited states
作者
关键词
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出版物
JOURNAL OF CHEMICAL PHYSICS
Volume 149, Issue 20, Pages 204101
出版商
AIP Publishing
发表日期
2018-11-27
DOI
10.1063/1.5048988
参考文献
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注意:仅列出部分参考文献,下载原文获取全部文献信息。- Correlation Energy from the Adiabatic Connection Formalism for Complete Active Space Wave Functions
- (2018) Ewa Pastorczak et al. Journal of Chemical Theory and Computation
- Excitation energies from Görling–Levy perturbation theory along the range-separated adiabatic connection
- (2018) Elisa Rebolini et al. MOLECULAR PHYSICS
- Electron Correlation from the Adiabatic Connection for Multireference Wave Functions
- (2018) Katarzyna Pernal PHYSICAL REVIEW LETTERS
- Electronic Excited States from the Adiabatic-Connection Formalism with Complete Active Space Wave Functions
- (2018) Ewa Pastorczak et al. Journal of Physical Chemistry Letters
- Correlation energy from random phase approximations: A reduced density matrices perspective
- (2017) Katarzyna Pernal INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY
- A minimalistic approach to static and dynamic electron correlations: Amending generalized valence bond method with extended random phase approximation correlation correction
- (2016) Koushik Chatterjee et al. JOURNAL OF CHEMICAL PHYSICS
- A time-dependent formulation of multi-reference perturbation theory
- (2016) Alexander Yu. Sokolov et al. JOURNAL OF CHEMICAL PHYSICS
- Excited states from range-separated density-functional perturbation theory
- (2015) Elisa Rebolini et al. MOLECULAR PHYSICS
- Calculating excitation energies by extrapolation along adiabatic connections
- (2015) Elisa Rebolini et al. PHYSICAL REVIEW A
- Excitation energies along a range-separated adiabatic connection
- (2014) Elisa Rebolini et al. JOURNAL OF CHEMICAL PHYSICS
- How accurate is the strongly orthogonal geminal theory in predicting excitation energies? Comparison of the extended random phase approximation and the linear response theory approaches
- (2014) Katarzyna Pernal et al. JOURNAL OF CHEMICAL PHYSICS
- Intergeminal Correction to the Antisymmetrized Product of Strongly Orthogonal Geminals Derived from the Extended Random Phase Approximation
- (2014) Katarzyna Pernal Journal of Chemical Theory and Computation
- Generalised adiabatic connection in ensemble density-functional theory for excited states: example of the H2 molecule
- (2013) Odile Franck et al. MOLECULAR PHYSICS
- The Dalton quantum chemistry program system
- (2013) Kestutis Aidas et al. Wiley Interdisciplinary Reviews-Computational Molecular Science
- Excitation energies from extended random phase approximation employed with approximate one- and two-electron reduced density matrices
- (2012) Koushik Chatterjee et al. JOURNAL OF CHEMICAL PHYSICS
- Random-phase approximation and its applications in computational chemistry and materials science
- (2012) Xinguo Ren et al. JOURNAL OF MATERIALS SCIENCE
- Electron correlation methods based on the random phase approximation
- (2012) Henk Eshuis et al. THEORETICAL CHEMISTRY ACCOUNTS
- Correlation Energy Expressions from the Adiabatic-Connection Fluctuation–Dissipation Theorem Approach
- (2011) János G. Ángyán et al. Journal of Chemical Theory and Computation
- Accurate calculation and modeling of the adiabatic connection in density functional theory
- (2010) A. M. Teale et al. JOURNAL OF CHEMICAL PHYSICS
- Random phase approximation correlation energies with exact Kohn–Sham exchange
- (2010) Andreas Heßelmann et al. MOLECULAR PHYSICS
- A study of cumulant approximations to n-electron valence multireference perturbation theory
- (2009) Dominika Zgid et al. JOURNAL OF CHEMICAL PHYSICS
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