Implementation of Divide-and-Conquer (DC) Electronic Structure Code to GAMESS Program Package
Author:
Publisher
Society of Computer Chemistry Japan
Subject
General Medicine
Link
http://www.jstage.jst.go.jp/article/jccj/8/1/8_H2027/_pdf
Reference20 articles.
1. Derivation and efficient implementation of the fast multipole method
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3. Atomic-pair theorem for universal matrix representatives of molecules and atomic clusters in non-relativistic Born-Oppenheimer approximation;Journal of Mathematical Physics;2018-07
4. An effective energy gradient expression for divide-and-conquer second-order Møller–Plesset perturbation theory;The Journal of Chemical Physics;2013-01-28
5. Dynamic hyperpolarizability calculations of large systems: The linear-scaling divide-and-conquer approach;The Journal of Chemical Physics;2012-02-28
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