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molecular dynamics (2)
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Keyword: molecular dynamics
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2 records found.
Adsorption of Cs Ions in Hydroxy-Al Interlayered Clay Minerals and the Aging Mechanism
Article
Creator
Hiroshi Sakuma
;
Kenji Tamura
;
Shigeru Suehara
;
Kenjiro Hashi
Keyword
Cesium
,
phlogopite
,
vermiculite
,
NMR
,
molecular dynamics
,
DFT
Date published
2026-03-03
Updated at
2026-03-05 16:30:12 +0900
材料研究のツールとして第一原理計算を使うために
Article
Creator
末原 茂
Keyword
シミュレーション
,
第一原理計算
,
化学反応
,
分子動力学
,
First-Principles calculation
,
molecular dynamics
,
Nudged elastic band
Date published
Updated at
2024-08-05 16:30:13 +0900
Keyword
molecular dynamics
(2)
Cesium
(1)
DFT
(1)
First-Principles calculation
(1)
NMR
(1)
Nudged elastic band
(1)
phlogopite
(1)
vermiculite
(1)
シミュレーション
(1)
分子動力学
(1)
化学反応
(1)
第一原理計算
(1)
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