Calculatioins of isomerization energies of alkanes using long-range corrected DFT combined with intramoleculaz van der Waals correction
Calculatioins of isomerization energies of alkanes using long-range corrected DFT combined with intramoleculaz van der Waals correction
复制标题
长程校正DFT结合分子内范德华校正计算烷烃异构化能
DOI:
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发表时间:
2010
期刊:
影响因子:
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通讯作者:
Kimihiko Hirao
中科院分区:
文献类型:
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作者:
Jong-Won Song;Takao Tsuneda;Kimihiko Hirao