Møller–Plesset perturbation theory (MP) is one of several quantum chemistry post-Hartree–Fock ab initio methods in the field of computational… (More)

Semantic Scholar uses AI to extract papers important to this topic.

2011

2011

- Stefan Grimme
- 2011

Related Articles Basis set convergence of explicitly correlated double-hybrid density functional theory calculations J. Chem… (More)

Is this relevant?

2011

2011

- Uttam Sinha Mahapatra, Sudip Chattopadhyay, Rajat K. Chaudhuri
- Journal of Computational Chemistry
- 2011

The complete active space spin-free state-specific multireference Møller-Plesset perturbation theory (SS-MRMPPT) based on the… (More)

Is this relevant?

2011

2011

- Dieter Cremer
- 2011

The development of Møller–Plesset perturbation theory (MPPT) has seen four different periods in almost 80 years. In the first 40… (More)

Is this relevant?

2008

2008

We study convergence or divergence of the Møller–Plesset Perturbation series for systems with two electrons and a single nucleus… (More)

Is this relevant?

2008

2008

Some methods for the convergence acceleration of the Møller-Plesset perturbation series for the correlation energy are discussed… (More)

Is this relevant?

2008

2008

- József Csontos, Nicholas Y. Palermo, Richard F. Murphy, Sándor Lovas
- Journal of Computational Chemistry
- 2008

The interaction energies of ubiquitous weakly polar interactions in proteins are comparable with those of hydrogen bonds… (More)

Is this relevant?

2007

2007

- Dmitri G. Fedorov, Kazuya Ishimura, Toyokazu Ishida, Kazuo Kitaura, Peter Pulay, Shigeru Nagase
- Journal of Computational Chemistry
- 2007

The three-body energy expansion in the fragment molecular orbital method (FMO) was applied to the 2nd order Møller-Plesset theory… (More)

Is this relevant?

2004

2004

A modified version of the Møller-Plesset approach for obtaining the correlation energy associated to a Hartree-Fock ground state… (More)

Is this relevant?

2003

2003

- Stefan Grimme
- Journal of Computational Chemistry
- 2003

Based on a partitioning of the total correlation energy into contributions from parallel- and antiparallel-spin pairs of… (More)

Is this relevant?

2002

2002

- Henryk A. Witek, Yoong-Kee Choe, James P. Finley, Kimihiko Hirao
- Journal of Computational Chemistry
- 2002

A new perturbation approach is proposed that enhances the low-order, perturbative convergence by modifying the zeroth-order… (More)

Is this relevant?