A New Benchmark Set for Excitation Energy of Charge Transfer States: Systematic Investigation of Coupled Cluster Type Methods.

作者： Balázs Kozma , Attila Tajti , Baptiste Demoulin , Róbert Izsák , Marcel Nooijen

关键词:

摘要: The numerous existing publications on benchmarking quantum chemistry methods for excited states rarely include Charge Transfer (CT) states, although many interesting phenomena in, e.g., biochemistr...

参考文章(0)

A New Benchmark Set for Excitation Energy of Charge Transfer States: Systematic Investigation of Coupled Cluster Type Methods.

来源期刊

我的账户

A New Benchmark Set for Excitation Energy of Charge Transfer States: Systematic Investigation of Coupled Cluster Type Methods.

来源期刊

相似文章 10

我的账户