文献
J-GLOBAL ID:201902239873331509
整理番号:19A0659892
QM応用のために調整された古典的力場:それは本当に実行可能な戦略か?【JST・京大機械翻訳】
Classical Force Fields Tailored for QM Applications: Is It Really a Feasible Strategy?
著者 (6件):
Andreussi Oliviero
(Institute of Computational Science, Universita della Svizzera Italiana, Switzerland)
,
Andreussi Oliviero
(Theory and Simulations of Materials (THEOS) and National Centre for Computational Design and Discovery of Novel Materials (MARVEL), Ecole Polytechnique Federale de Lausanne, Switzerland)
,
Prandi Ingrid G.
(Department of Chemistry, University of Pisa, Italy)
,
Campetella Marco
(Department of Chemistry, University of Pisa, Italy)
,
Prampolini Giacomo
(CNR, UOS Pisa, Istituto di Chimica dei Composti OrganoMetallici ICCOM CNR, Italy)
,
Mennucci Benedetta
(Department of Chemistry, University of Pisa, Italy)
資料名:
Journal of Chemical Theory and Computation
(Journal of Chemical Theory and Computation)
巻:
13
号:
10
ページ:
4636-4648
発行年:
2017年
JST資料番号:
W2328A
ISSN:
1549-9618
CODEN:
JCTCCE
資料種別:
逐次刊行物 (A)
記事区分:
原著論文
発行国:
アメリカ合衆国 (USA)
言語:
英語 (EN)