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Møller–Plesset perturbation theory
Known as:
Møller-Plesset
, Moller–Plesset perturbation theory
, Møller-Plesset pertubation theory
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Møller–Plesset perturbation theory (MP) is one of several quantum chemistry post-Hartree–Fock ab initio methods in the field of computational…
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Related topics
Related topics
39 relations
Ab initio quantum chemistry methods
CP2K
Complete active space perturbation theory
Coupled cluster
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Broader (1)
Computational chemistry
Papers overview
Semantic Scholar uses AI to extract papers important to this topic.
2008
2008
Does Møller – Plesset perturbation theory converge ?
S. Herman
,
G. Hagedorn
2008
Corpus ID: 12919652
We study convergence or divergence of the Møller–Plesset Perturbation series for systems with two electrons and a single nucleus…
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Highly Cited
2006
Highly Cited
2006
Electronic structure, Raman and infrared spectra, and vibrational assignment of carboplatin. Density functional theory studies † † The authors dedicate this paper to Professor Henryk Chojnacki on the…
R. Wysokiński
,
J. Kuduk-Jaworska
,
D. Michalska
2006
Corpus ID: 20001557
2002
2002
Møller–Plesset Perturbation Theory
D. Cremer
2002
Corpus ID: 94436665
2000
2000
Molecular Geometries at Sixth Order Møller−Plesset Perturbation Theory. At What Order Does MP Theory Give Exact Geometries?
Yuan-Yao He
,
D. Cremer
2000
Corpus ID: 59441847
Sixth order Moller−Plesset perturbation theory (MP6) in connection with correlation consistent basis sets cc-pVDZ, cc-pVTZ, and…
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Highly Cited
2000
Highly Cited
2000
Calculating the acidity of silanols and related oxyacids in aqueous solution
J. Tossell
,
Nita Sahai
2000
Corpus ID: 45566931
Highly Cited
1997
Highly Cited
1997
Male detention affects extra-pair copulation frequency and pair behaviour in western bluebirds
J. Dickinson
Animal Behaviour
1997
Corpus ID: 53200440
Abstract Male western bluebirds, Sialia mexicana show patterns of mate following consistent with mate guarding. The hypothesis…
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1997
1997
The structure of phenol-ammonia clusters before and after proton transfer. A theoretical investigation
W. Siebrand
,
M. Zgierski
,
Z. Smedarchina
,
M. Vener
,
J. Kaneti
1997
Corpus ID: 98525396
1997
1997
NMR Shieldings in Benzoyl and 2-Hydroxybenzoyl Compounds. Experimental versus GIAO Calculated Data
H. Lampert
,
W. Mikenda
,
A. Karpfen
,
H. Kählig
1997
Corpus ID: 94865331
GIAO-calculated NMR chemical shifts (1H, 13C, and 17O) as obtained at various computational levels are reported for the three…
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Highly Cited
1996
Highly Cited
1996
Confidence of paternity, actual paternity and parental effort by purple martins
R. Wagner
,
M. D. Schug
,
E. Morton
Animal Behaviour
1996
Corpus ID: 53191318
Abstract Abstract. Parental effort by socially monogamous purple martins was measured to test the hypothesis that males reduce…
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Highly Cited
1995
Highly Cited
1995
The geometry of pyrazole: A test for ab initio calculations
A. Llamas-Saiz
,
C. Foces-Foces
,
O. Mó
,
M. Yáñez
,
E. Elguero
,
J. Elguero
Journal of Computational Chemistry
1995
Corpus ID: 39216530
Ab initio calculations on the structure of pyrazole have been carried out at different levels of accuracy. At the Hartree‐Fock…
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