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【求助已成功】VASP的Warning及奇怪的错误？ 谢谢
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VASP计算状态方程的奇怪问题？ Mo-bcc的状态方程计算出现下面问题？ 没设NGX，NGY，NGZ的值出现下面的警告提示？这个提示对计算结果影响大吗？ WARNING: wrap around error must be expected set NGX to 20 根据提示设置 NGX=40;NGY=48;NGZ=48，WARNING:没有了，但是又出现下面的问题.请问NGX，NGY，NGZ到底代表什么呀？看手册没看明白,请大家指点一下，快崩溃了。 计算几步以后一直出现下面的信息，计算不往下进行了 hit a member that was already found in another star hit a member that was already found in another star hit a member that was already found in another star hit a member that was already found in another star hit a member that was already found in another star hit a member that was already found in another star hit a member that was already found in another star hit a member that was already found in another star hit a member that was already found in another star hit a member that was already found in another star hit a member that was already found in another star hit a member that was already found in another star hit a member that was already found in another star hit a member that was already found in another star [ Last edited by xiaowu787 on 2010-12-4 at 10:06 ] |
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