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How to CASSCF, tutorial with ORCA

Prof Nicolas

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How to CASSCF, tutorial with ORCA

9 899 просмотров · 5 лет назад
Prof Nicolas
3,22 тыс. подписчиков
9 899 просмотров · 5 лет назад
In this video I show how to submit a CASSCF calculation with ORCA on a high-spin Co(II) complex, and talk about some of the information that the CASSCF calculation gives.