On the exact formulation of multi-configuration density-functional theory: electron density versus orbitals occupation
出版年份 2015 全文链接
标题
On the exact formulation of multi-configuration density-functional theory: electron density versus orbitals occupation
作者
关键词
-
出版物
MOLECULAR PHYSICS
Volume 113, Issue 5, Pages 419-434
出版商
Informa UK Limited
发表日期
2015-01-13
DOI
10.1080/00268976.2014.993342
参考文献
相关参考文献
注意:仅列出部分参考文献,下载原文获取全部文献信息。- Perspective on natural orbital functional theory
- (2014) Mario Piris et al. INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY
- Alternative separation of exchange and correlation energies in multi-configuration range-separated density-functional theory
- (2013) Alexandrina Stoyanova et al. JOURNAL OF CHEMICAL PHYSICS
- Density Matrix Embedding: A Strong-Coupling Quantum Embedding Theory
- (2013) Gerald Knizia et al. Journal of Chemical Theory and Computation
- Density functionals and model Hamiltonians: Pillars of many-particle physics
- (2013) Klaus Capelle et al. PHYSICS REPORTS-REVIEW SECTION OF PHYSICS LETTERS
- A multiconfigurational hybrid density-functional theory
- (2012) Kamal Sharkas et al. JOURNAL OF CHEMICAL PHYSICS
- Density Matrix Embedding: A Simple Alternative to Dynamical Mean-Field Theory
- (2012) Gerald Knizia et al. PHYSICAL REVIEW LETTERS
- Multireference Nature of Chemistry: The Coupled-Cluster View
- (2011) Dmitry I. Lyakh et al. CHEMICAL REVIEWS
- Dynamical mean-field theory from a quantum chemical perspective
- (2011) Dominika Zgid et al. JOURNAL OF CHEMICAL PHYSICS
- Multiconfiguration second-order perturbation theory approach to strong electron correlation in chemistry and photochemistry
- (2011) Daniel Roca-Sanjuán et al. Wiley Interdisciplinary Reviews-Computational Molecular Science
- Range-dependent adiabatic connections
- (2010) A. M. Teale et al. JOURNAL OF CHEMICAL PHYSICS
- Range separation combined with the Overhauser model: Application to the H2molecule along the dissociation curve
- (2009) Paola Gori-Giorgi et al. INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY
- On the universality of the long-/short-range separation in multiconfigurational density-functional theory. II. Investigating f[sup 0] actinide species
- (2009) Emmanuel Fromager et al. JOURNAL OF CHEMICAL PHYSICS
- Analysis of multi-configuration density functional theory methods: theory and model application to bond-breaking
- (2009) Yair Kurzweil et al. MOLECULAR PHYSICS
- Multiconfiguration optimized effective potential method for a density-functional treatment of static correlation
- (2008) Martin Weimer et al. JOURNAL OF CHEMICAL PHYSICS
- Self-consistent many-body perturbation theory in range-separated density-functional theory: A one-electron reduced-density-matrix-based formulation
- (2008) Emmanuel Fromager et al. PHYSICAL REVIEW A
Find the ideal target journal for your manuscript
Explore over 38,000 international journals covering a vast array of academic fields.
SearchCreate your own webinar
Interested in hosting your own webinar? Check the schedule and propose your idea to the Peeref Content Team.
Create Now