原名:PDF (Figures showing all unimolecular reaction channels of the OH adducts; quantum chemical by Luc Vereecken
作品简介:为了评估 M06-2X/aug-cc-pVTZ 计算的稳健性,我们将其与单点能量计算进行了比较……
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原名:PDF (Figures showing all unimolecular reaction channels of the OH adducts; quantum chemical by Luc Vereecken
作品简介:为了评估 M06-2X/aug-cc-pVTZ 计算的稳健性,我们将其与单点能量计算进行了比较……