Open songruipku opened 1 month ago
目前研究广泛,需求迫切的两种锕系元素U和Pu的轨道赝势仍然缺乏,希望能用ABACUS做相关研究。
在可供下载的轨道赝势库中增加U和Pu的赝势。
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Background
目前研究广泛,需求迫切的两种锕系元素U和Pu的轨道赝势仍然缺乏,希望能用ABACUS做相关研究。
Describe the solution you'd like
在可供下载的轨道赝势库中增加U和Pu的赝势。
Task list only for developers
Notice Possible Changes of Behavior (Reminder only for developers)
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Notice any changes of core modules (Reminder only for developers)
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Notice Possible Changes of Core Modules (Reminder only for developers)
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Additional Context
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Task list for Issue attackers (only for developers)