4.7 Article

Communication: Bond length alternation of conjugated oligomers: Another step on the fifth rung of Perdew's ladder of functional

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。
Article Chemistry, Physical

Locally Range-Separated Hybrids as Linear Combinations of Range-Separated Local Hybrids

Thomas M. Henderson et al.

INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY (2009)

Article Chemistry, Physical

Some Fundamental Issues in Ground-State Density Functional Theory: A Guide for the Perplexed

John P. Perdew et al.

JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2009)

Article Chemistry, Physical

Assessment of the efficiency of long-range corrected functionals for some properties of large compounds

Denis Jacquemin et al.

JOURNAL OF CHEMICAL PHYSICS (2007)

Article Chemistry, Physical

On the universality of the long-/short-range separation in multiconfigurational density-functional theory

Emmanuel Fromager et al.

JOURNAL OF CHEMICAL PHYSICS (2007)

Article Chemistry, Physical

Assessment of a long-range corrected hybrid functional

Oleg A. Vydrov et al.

JOURNAL OF CHEMICAL PHYSICS (2006)

Article Chemistry, Physical

Semiempirical hybrid density functional with perturbative second-order correlation

S Grimme

JOURNAL OF CHEMICAL PHYSICS (2006)

Article Chemistry, Physical

Second-order Moller-Plesset evaluation of the bond length alternation of several series of linear oligomers

D Jacquemin et al.

JOURNAL OF PHYSICAL CHEMISTRY A (2005)

Article Chemistry, Physical

Nonlinear optical property calculations by the long-range-corrected coupled-perturbed Kohn-Sham method

Muneaki Kamiya et al.

JOURNAL OF CHEMICAL PHYSICS (2005)

Article Chemistry, Physical

Short-range exchange and correlation energy density functionals: Beyond the local-density approximation

J Toulouse et al.

JOURNAL OF CHEMICAL PHYSICS (2005)

Article Chemistry, Physical

A new hybrid exchange-correlation functional using the Coulomb-attenuating method (CAM-B3LYP)

T Yanai et al.

CHEMICAL PHYSICS LETTERS (2004)

Article Chemistry, Physical

A long-range-corrected time-dependent density functional theory

Y Tawada et al.

JOURNAL OF CHEMICAL PHYSICS (2004)

Article Chemistry, Physical

A long-range correction scheme for generalized-gradient-approximation exchange functionals

H Iikura et al.

JOURNAL OF CHEMICAL PHYSICS (2001)