Reinvestigation of the reaction of ethylene and singlet oxygen by approximate spin projection (AP)method.Comparison with multi-reference coupled-cluster (MRCC) calculations.

Reinvestigation of the reaction of ethylene and singlet oxygen by approximate spin projection (AP)method.Comparison with multi-reference coupled-cluster (MRCC) calculations.
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通过近似自旋投影 (AP) 方法重新研究乙烯和单线态氧的反应。与多参考耦合簇 (MRCC) 计算进行比较。

DOI:
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发表时间:
2010
影响因子:
2.9
通讯作者:
Toru Saito
Toru Saito
中科院分区:
化学3区
文献类型:
--
作者:
Kaneko H;Inasawa S;Inokuchi H;Funatsu K;Toru Saito;Toru Saito;Toru Saito;Toru Saito;Toru Saito;Toru Saito;Toru Saito;Toru Saito;Toru Saito;Toru Saito

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