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眼睛寶寶銅蟲 (初入文壇)
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[求助]
計(jì)算納米團(tuán)簇,發(fā)生如下的警告,為什么 已有1人參與
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Warning: There are no empty bands for at least one kpoint and spin; this may slow the convergence and/or lead to an inaccurate groundstate. If this warning persists, you should consider increasing nextra_bands and/or reducing smearing_width in the param file. Recommend using nextra_bands of about 106. |


銅蟲 (初入文壇)

銅蟲 (初入文壇)

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