A perfect in phase FD algorithm for problems in quantum chemistry

A perfect in phase FD algorithm for problems in quantum chemistry

Our research pays attention to the deployment of newly algorithm which is useful on quantum chemical problems.

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Veröffentlicht in:Journal of mathematical chemistry 2019-10, Vol.57 (9), p.2019-2048
Hauptverfasser: Qiu, Junlai, Huang, Junjie, Simos, T. E.
Format: Artikel
Sprache:eng
Schlagworte:
Algorithms
Chemistry
Chemistry and Materials Science
Math. Applications in Chemistry
Organic chemistry
Original Paper
Physical Chemistry
Quantum chemistry
Theoretical and Computational Chemistry
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Beschreibung
Zusammenfassung:Our research pays attention to the deployment of newly algorithm which is useful on quantum chemical problems.
ISSN:0259-9791
1572-8897
DOI:10.1007/s10910-019-01061-w