文献
J-GLOBAL ID:202202216610493797
整理番号:22A0727053
Bad対Worseの選択:一般的密度汎関数近似に基づく二光子吸収強度の予測【JST・京大機械翻訳】
Choosing Bad versus Worse: Predictions of Two-Photon-Absorption Strengths Based on Popular Density Functional Approximations
著者 (9件):
Choluj Marta
(Faculty of Chemistry, Wroclaw University of Science and Technology, Poland)
,
Alam Md. Mehboob
(Department of Chemistry, Indian Institute of Technology Bhilai, Chhattisgarh, India)
,
Beerepoot Maarten T. P.
(Hylleraas Centre for Quantum Molecular Sciences, Department of Chemistry, UiT The Arctic University of Norway, Norway)
,
Sitkiewicz Sebastian P.
(Donostia International Physics Center (DIPC), Euskadi, Spain)
,
Sitkiewicz Sebastian P.
(Kimika Fakultatea, Euskal Herriko Unibertsitatea (UPV/EHU), Euskadi, Spain)
,
Matito Eduard
(Donostia International Physics Center (DIPC), Euskadi, Spain)
,
Matito Eduard
(Ikerbasque Foundation for Science, Euskadi, Spain)
,
Ruud Kenneth
(Hylleraas Centre for Quantum Molecular Sciences, Department of Chemistry, UiT The Arctic University of Norway, Norway)
,
Zalesny Robert
(Faculty of Chemistry, Wroclaw University of Science and Technology, Poland)
資料名:
Journal of Chemical Theory and Computation
(Journal of Chemical Theory and Computation)
巻:
18
号:
2
ページ:
1046-1060
発行年:
2022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)