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chanboni: ½ð±Ò+2 2015-01-03 19:45:35
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31Â¥2015-01-03 16:06:49
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32Â¥2015-01-04 08:59:27
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chanboni

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31Â¥: Originally posted by quantumor at 2015-01-03 16:06:49
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33Â¥2015-01-04 17:01:38
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quantumor

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chanboni: ½ð±Ò+5 2015-01-04 19:37:09
ÒýÓûØÌû:
33Â¥: Originally posted by chanboni at 2015-01-04 17:01:38
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kong890109

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chanboni: ½ð±Ò+5 2015-01-05 12:41:57
# opt b3lyp/6-311+g(d,p)

OH

-1 1
O                  0.12594458    0.28967254    0.00000000
H                 -0.19451000    1.19460837    0.00000000
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35Â¥2015-01-05 10:17:52
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chanboni

гæ (ÕýʽдÊÖ)

ÒýÓûØÌû:
35Â¥: Originally posted by kong890109 at 2015-01-05 10:17:52
# opt b3lyp/6-311+g(d,p)

OH

-1 1
O                  0.12594458    0.28967254    0.00000000
H                 -0.19451000    1.19460837    0.00000000
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#opt freq b31yp/6-31g(d)
-1 1
O                  0.12594458    0.28967254    0.00000000
H                 -0.19451000    1.19460837    0.00000000
36Â¥2015-01-05 12:41:51
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wbf3ng

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chanboni: ½ð±Ò+5 2015-01-07 21:43:53
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