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作者 gogomanX 在 PTT [ Chemistry ] 看板的留言(推文), 共4則
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[學習] 關於GAUSSIAN軟體
[ Chemistry ]36 留言, 推噓總分: +1
作者: gogomanX - 發表於 2010/10/05 12:43(13年前)
8F→gogomanX:感謝樓上的回答 我的JOB TYOE確實是選opti to minimum10/05 17:08
9F→gogomanX:可是這樣他把H接上兩個C 感覺不是不太合理嗎?10/05 17:09
10F→gogomanX:有辦法要他做最佳化結構 但不加上額外鍵的指令嗎?10/05 17:10
11F→gogomanX:不最佳化的話算出來的HOMO和DIPOLE應該會跑掉吧@@10/05 17:10
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