4.7 Article

Explicitly correlated coupled cluster F12 theory with single and double excitations

Related references

Note: Only part of the references are listed.
Article Chemistry, Physical

Diagonal orbital-invariant explicitly-correlated coupled-cluster method

David P. Tew et al.

CHEMICAL PHYSICS LETTERS (2008)

Article Chemistry, Physical

Coupled-cluster methods with perturbative inclusion of explicitly correlated terms: a preliminary investigation

Edward F. Valeev

PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2008)

Article Chemistry, Physical

A simple and efficient CCSD(T)-F12 approximation

Thomas B. Adler et al.

JOURNAL OF CHEMICAL PHYSICS (2007)

Article Chemistry, Physical

Quintuple-zeta quality coupled-cluster correlation energies with triple-zeta basis sets

David P. Tew et al.

PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2007)

Review Chemistry, Physical

R12 methods in explicitly correlated molecular electronic structure theory

Wim Klopper et al.

INTERNATIONAL REVIEWS IN PHYSICAL CHEMISTRY (2006)

Article Chemistry, Physical

Explicitly correlated second-order perturbation theory using density fitting and local approximations

HJ Werner et al.

JOURNAL OF CHEMICAL PHYSICS (2006)

Article Chemistry, Physical

Alternative formulation of the matrix elements in MP2-R12 theory

S Kedzuch et al.

INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY (2005)

Article Chemistry, Physical

New correlation factors for explicitly correlated electronic wave functions

DP Tew et al.

JOURNAL OF CHEMICAL PHYSICS (2005)

Article Chemistry, Physical

Universal R12 suited basis sets for atoms from lithium to fluorine

S Kedzuch et al.

MOLECULAR PHYSICS (2005)

Article Chemistry, Physical

Analysis of the errors in explicitly correlated electronic structure theory

AJ May et al.

PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2005)

Article Chemistry, Physical

Improving on the resolution of the identity in linear R12 ab initio theories

EF Valeev

CHEMICAL PHYSICS LETTERS (2004)

Article Chemistry, Physical

An explicitly correlated second order Moller-Plesset theory using a frozen Gaussian geminal

AJ May et al.

JOURNAL OF CHEMICAL PHYSICS (2004)

Article Chemistry, Physical

Initiation of explicitly correlated Slater-type geminal theory

S Ten-No

CHEMICAL PHYSICS LETTERS (2004)

Article Chemistry, Multidisciplinary

Similarity-transformed Hamiltonians by means of Gaussian-damped interelectronic distances

HJA Zweistra et al.

COLLECTION OF CZECHOSLOVAK CHEMICAL COMMUNICATIONS (2003)

Article Chemistry, Multidisciplinary

Towards universal R12 consistent basis sets

J Noga et al.

COLLECTION OF CZECHOSLOVAK CHEMICAL COMMUNICATIONS (2003)

Article Chemistry, Physical

Explicitly correlated second-order Moller-Plesset methods with auxiliary basis sets

W Klopper et al.

JOURNAL OF CHEMICAL PHYSICS (2002)

Article Chemistry, Physical

The accurate determination of molecular equilibrium structures

KL Bak et al.

JOURNAL OF CHEMICAL PHYSICS (2001)

Article Chemistry, Physical

Explicitly correlated R12 coupled cluster calculations for open shell systems

J Noga et al.

CHEMICAL PHYSICS LETTERS (2000)