标题
Implementation and assessment of a simple nonlocal van der Waals density functional
作者
关键词
-
出版物
JOURNAL OF CHEMICAL PHYSICS
Volume 132, Issue 16, Pages 164113
出版商
AIP Publishing
发表日期
2010-04-29
DOI
10.1063/1.3398840
参考文献
相关参考文献
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- Improving the accuracy of the nonlocal van der Waals density functional with minimal empiricism
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- Long-range-corrected hybrid density functionals including random phase approximation correlation: Application to noncovalent interactions
- (2009) Benjamin G. Janesko et al. JOURNAL OF CHEMICAL PHYSICS
- Density functional method including weak interactions: Dispersion coefficients based on the local response approximation
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- Van der Waals Interactions in Density-Functional Theory: Rare-Gas Diatomics
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- Investigation of Exchange Energy Density Functional Accuracy for Interacting Molecules
- (2009) Éamonn D. Murray et al. Journal of Chemical Theory and Computation
- An Assessment of Theoretical Methods for Nonbonded Interactions: Comparison to Complete Basis Set Limit Coupled-Cluster Potential Energy Curves for the Benzene Dimer, the Methane Dimer, Benzene−Methane, and Benzene−H2S†
- (2009) C. David Sherrill et al. JOURNAL OF PHYSICAL CHEMISTRY A
- A density functional for sparse matter
- (2009) D C Langreth et al. JOURNAL OF PHYSICS-CONDENSED MATTER
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- (2009) Jiří Klimeš et al. JOURNAL OF PHYSICS-CONDENSED MATTER
- Linear-scaling self-consistent implementation of the van der Waals density functional
- (2009) Andris Gulans et al. PHYSICAL REVIEW B
- Nonlocal van der Waals Density Functional Made Simple
- (2009) Oleg A. Vydrov et al. PHYSICAL REVIEW LETTERS
- Adiabatic-Connection Fluctuation-Dissipation Density-Functional Theory Based on Range Separation
- (2009) Julien Toulouse et al. PHYSICAL REVIEW LETTERS
- Ab initioCalculation of van der Waals Bonded Molecular Crystals
- (2009) Deyu Lu et al. PHYSICAL REVIEW LETTERS
- Accurate Bulk Properties from Approximate Many-Body Techniques
- (2009) Judith Harl et al. PHYSICAL REVIEW LETTERS
- Efficient Implementation of a van der Waals Density Functional: Application to Double-Wall Carbon Nanotubes
- (2009) Guillermo Román-Pérez et al. PHYSICAL REVIEW LETTERS
- Predicting CH/π Interactions with Nonlocal Density Functional Theory
- (2008) Joe Hooper et al. CHEMPHYSCHEM
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- (2008) Oleg A. Vydrov et al. JOURNAL OF CHEMICAL PHYSICS
- Developing the random phase approximation into a practical post-Kohn–Sham correlation model
- (2008) Filipp Furche JOURNAL OF CHEMICAL PHYSICS
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