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。Exact-exchange energy density in the gauge of a semilocal density-functional approximation
Jianmin Tao et al.
PHYSICAL REVIEW A (2008)
Local hybrid functionals: An assessment for thermochemical kinetics
Martin Kaupp et al.
JOURNAL OF CHEMICAL PHYSICS (2007)
Local hybrid functionals based on density matrix products
Benjamin G. Janesko et al.
JOURNAL OF CHEMICAL PHYSICS (2007)
Nuclear shielding constants from localized local hybrid exchange-correlation potentials
Alexei V. Arbuznikov et al.
CHEMICAL PHYSICS LETTERS (2007)
Modeling the adiabatic connection in H2
Michael J. G. Peach et al.
JOURNAL OF CHEMICAL PHYSICS (2007)
Local hybrid exchange-correlation functionals based on the dimensionless density gradient
Alexei V. Arbuznikov et al.
CHEMICAL PHYSICS LETTERS (2007)
A thermochemically competitive local hybrid functional without gradient corrections
Hilke Bahmann et al.
JOURNAL OF CHEMICAL PHYSICS (2007)
Importance of short-range versus long-range Hartree-Fock exchange for the performance of hybrid density functionals
Oleg A. Vydrov et al.
JOURNAL OF CHEMICAL PHYSICS (2006)
Localized hybrid exchange-correlation Potentials for Kohn-Sham DFT calculations of NMR and EPR parameters
AV Arbuznikov et al.
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY (2005)
Multi-coefficient extrapolated density functional theory for thermochemistry and thermochemical kinetics
Y Zhao et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2005)
Unrestricted open-shell Kohn-Sham scheme with local hybrid exchange-correlation potentials:: improved calculation of electronic g-tensors for transition-metal complexes
AV Arbuznikov et al.
CHEMICAL PHYSICS LETTERS (2004)
Small representative benchmarks for thermochemical calculations
BJ Lynch et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2003)
Climbing the density functional ladder: Nonempirical meta-generalized gradient approximation designed for molecules and solids
JM Tao et al.
PHYSICAL REVIEW LETTERS (2003)
Local hybrid functionals
J Jaramillo et al.
JOURNAL OF CHEMICAL PHYSICS (2003)
Adiabatic connection from accurate wave-function calculations
D Frydel et al.
JOURNAL OF CHEMICAL PHYSICS (2000)
Assessment of Gaussian-3 and density functional theories for a larger experimental test set
LA Curtiss et al.
JOURNAL OF CHEMICAL PHYSICS (2000)
分享论文
