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- W2322427609 abstract "石炭の高度利用技術の開発には石炭構造に関する知見が必要であるとの見地から, コンピュータを用いた石炭三次元構造のシミュレーションを行った.棗庄炭 (中国の瀝青炭) のピリジン可溶成分の構造モデルを構築した.石炭芳香族クラスターをつなぐ結合鎖の長さを変えた構造モデルに対して, 独自のシミュレーション法で密度を推算した.その結果, 結合鎖の長さが2炭素原子の構造モデルの密度値が, 実測値と良く一致することが分かった.またその時の構造モデルが最小エネルギー値を与えることが分かった." @default.
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- W2322427609 modified "2023-10-17" @default.
- W2322427609 title "Fossil Energy. Estimation of Length of Intercluster Bond in Coal by Density Simulation of Coal Molecular Model." @default.
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