SCOPUS 정보 검색 플랫폼

Volumn 132, Issue 21, 2010, Pages

Communications: Intramolecular basis set superposition error as a measure of basis set incompleteness: Can one reach the basis set limit without extrapolation?

(1) Balabin, Roman M a

a ETH ZURICH (Switzerland)

Author keywords

[No Author keywords available]

Indexed keywords

AB INITIO; BASIS SET SUPERPOSITION ERRORS; BASIS SETS; BASIS-SET LIMITS; BENCHMARK STUDY; COMPLETE BASIS SET LIMIT; DINGER EQUATION; ENERGY VALUE; ERROR SOURCES; FIRST-PRINCIPLES; HYDROGEN CYANIDE; MOLECULAR SYSTEMS; POWER LAW; POWER-LAW DEPENDENCES; SECOND ORDER PERTURBATION THEORY;

ACETYLENE; CARBON DIOXIDE; CYANIDES; ETHANOL; ETHYLENE; EXTRAPOLATION; LIGHTING; PERTURBATION TECHNIQUES;

ELECTRIC CIRCUIT BREAKERS;

EID: 77953578252 PISSN: 00219606 EISSN: None Source Type: Journal
DOI: 10.1063/1.3430647 Document Type: Article

Times cited : (42)

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