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                #ISMEAR = -5
                PREC = Normal

                LORBIT=11
                #LELF=.TRUE

                LSORBIT= .TRUE
                LMAXMIX=2
                #MAGMOM=15*0
                #SAXIS= 0 0 1
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5Â¥: Originally posted by skydark at 2015-03-30 14:05:25
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Liz_Tesla

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ÒýÓûØÌû:
2Â¥: Originally posted by skydark at 2015-03-30 02:27:03
µÚ2²½¾Í۳ɠ ICHARG = 11?
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Liz_Tesla

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ÒýÓûØÌû:
2Â¥: Originally posted by skydark at 2015-03-30 02:27:03
µÚ2²½¾Í۳ɠ ICHARG = 11?
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VASP ×ÔÐý¹ìµÀñîºÏ ÎÊÌâ-3
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4Â¥2015-03-30 09:49:23
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