【求助】求cif的B類錯(cuò)誤解決43
本人做個(gè)有機(jī)單晶,但Check時(shí)出現(xiàn)了B類錯(cuò)誤,怎么解決啊高手們,幫幫我
Alert level B
CELLV02_ALERT_1_B The supplied cell volume s.u. differs from that
calculated from the cell parameter s.u.'s by > 4
Calculated cell volume su = 22.83
Cell volume su given = 16.00
PLAT415_ALERT_2_B Short Inter D-H..H-X H1A .. H16 .. 2.07 Ang.
什么意思呢這兩個(gè)問(wèn)題該怎么解決啊?
[ Last edited by baiyuefei on 2011-2-19 at 15:54 ]
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那試一試讓H1A 和 H16 占有率加和為1
可以試試Q峰加氫呀~~
是O上的怎么辦?急解...謝謝
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