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huahua1981

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Originally posted by ľͷharry at 2008-4-24 07:39:
Sum of electronic and zero-point Energies
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7Â¥2008-04-24 08:46:38
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huahua1981

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Сºì¶¹(½ð±Ò+2,VIP+0):huida xinku le
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2Â¥2008-04-22 16:44:59
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ľͷharry

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ÓÃÕâ¸öÈ¥Ëã½áºÏÄÜFormation energies ¢EcomplexÓ¦¸ÃûÎÊÌâ°É

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Formation energies ¢Ecomplex for the complexes with C60 were
calculated according to the following formula

¢Ecomplex = Ecomplex - (EC60+ EP)
where E is the corresponding absolute energy and P is the
porphine ligand or its metal derivative.
3Â¥2008-04-22 17:34:09
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huahua1981

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