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The any particle molecular orbital approach: A short review of the theory and applications

Acceso Abierto
ID Minciencias: ART-0000663026-109
Ranking: ART-ART_A2

Abstract:

Abstract The any particle molecular orbital (APMO) approach extends regular electronic structure methods to study atomic and molecular systems in which electrons and other particles are treated simultaneously as quantum waves. A number of electronic structure methodologies have been extended under the APMO framework and applied to investigate nuclear quantum effects including isotope effects and nuclear delocalization and to calculate proton binding energies and affinities. In addition, APMO methodologies have been employed to analyze physical and chemical properties of atomic and molecular systems containing exotic subatomic particles.

Tópico:

Advanced Chemical Physics Studies

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Citations: 37
37

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Información de la Fuente:

SCImago Journal & Country Rank
FuenteInternational Journal of Quantum Chemistry
Cuartil año de publicaciónNo disponible
Volumen119
Issue2
Páginase25705 - N/A
pISSNNo disponible
ISSN0020-7608

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