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。First principles band structure calculations based on self-consistent screened Hartree-Fock exchange potential
Tomomi Shimazaki et al.
JOURNAL OF CHEMICAL PHYSICS (2009)
Electronic Structure Calculations under Periodic Boundary Conditions Based on the Gaussian and Fourier Transform (GFT) Method
Tomomi Shimazaki et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2009)
Screened hybrid density functionals for solid-state chemistry and physics
Benjamin G. Janesko et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2009)
Fast second-order many-body perturbation method for extended systems
So Hirata et al.
PHYSICAL REVIEW B (2009)
Band structure calculations based on screened Fock exchange method
Tomomi Shimazaki et al.
CHEMICAL PHYSICS LETTERS (2008)
Hybrid functionals with local range separation
Aliaksandr V. Krukau et al.
JOURNAL OF CHEMICAL PHYSICS (2008)
Why does the B3LYP hybrid functional fail for metals?
Joachim Paier et al.
JOURNAL OF CHEMICAL PHYSICS (2007)
Influence of the exchange screening parameter on the performance of screened hybrid functionals
Aliaksandr V. Krukau et al.
JOURNAL OF CHEMICAL PHYSICS (2006)
Energy band gaps and lattice parameters evaluated with the Heyd-Scuseria-Ernzerhof screened hybrid functional
J Heyd et al.
JOURNAL OF CHEMICAL PHYSICS (2005)
Efficient hybrid density functional calculations in solids: Assessment of the Heyd-Scuseria-Ernzerhof screened Coulomb hybrid functional
J Heyd et al.
JOURNAL OF CHEMICAL PHYSICS (2004)
Hybrid functionals based on a screened Coulomb potential
J Heyd et al.
JOURNAL OF CHEMICAL PHYSICS (2003)
All-electron projector-augmented-wave GW approximation:: Application to the electronic properties of semiconductors
B Arnaud et al.
PHYSICAL REVIEW B (2000)