Generalized and efficient algorithm for computing multipole energies and gradients based on Cartesian tensors.
Generalized and efficient algorithm for computing multipole energies and gradients based on Cartesian tensors.
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基于笛卡尔张量计算多极能量和梯度的通用且高效的算法。
DOI:
10.1063/1.4930984
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发表时间:
2015
期刊:
影响因子:
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通讯作者:
Lin,Dejun
中科院分区:
文献类型:
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作者:
Lin,Dejun