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happybank

铁虫 (初入文坛)

[求助] 希望找几篇关于用vasp计算掺杂后关于电荷补偿如何设置的文章

如题,因为要做不同价态的原子替换掺杂,但不知道在vasp如何设置电荷补偿,也没找到相关文件。所以希望各位有闲暇时能帮个忙,提供几篇文章或者详细说明下,谢谢谢谢!!
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sungjen

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同求啊
希望有一天成为大神
2楼2013-10-10 09:46:55
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