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會(huì)飛的種子新蟲 (小有名氣)
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[求助]
NBO輸出解析
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WARNING: 4 low occupancy (<1.9990e) core orbitals found on Pt 1 1 low occupancy (<1.9990e) core orbital found on C 5 1 low occupancy (<1.9990e) core orbital found on C 6 1 low occupancy (<1.9990e) core orbital found on C 7 1 low occupancy (<1.9990e) core orbital found on C 9 1 low occupancy (<1.9990e) core orbital found on C 11 1 low occupancy (<1.9990e) core orbital found on C 13 1 low occupancy (<1.9990e) core orbital found on C 14 1 low occupancy (<1.9990e) core orbital found on C 15 1 low occupancy (<1.9990e) core orbital found on C 17 1 low occupancy (<1.9990e) core orbital found on C 19 1 low occupancy (<1.9990e) core orbital found on C 23 1 low occupancy (<1.9990e) core orbital found on C 24 1 low occupancy (<1.9990e) core orbital found on C 26 1 low occupancy (<1.9990e) core orbital found on C 28 這個(gè)代表什么意思?特別是括號(hào)中的…… |
至尊木蟲 (著名寫手)
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你可以看看 http://www.gaoyang168.com/bbs/viewthread.php?tid=1724012&fpage=1中 【小卒個(gè)人文集】yjcmwgk原創(chuàng)的35個(gè)教程中的nbo分析,可能能找到你想要的。 |

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