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Benchmark of Semiempirical Methods

Posted on by Pavlo Dral Posted in Method Development, News — No Comments ↓

What is the best semiempirical method to use for your system? Find out in the most extensive benchmark study.

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Details on OMx Methods

Posted on by Pavlo Dral Posted in Method Development, News, Semiempirical Methods — 2 Comments ↓

Details about theory and implementation of up-to-now most advanced semiempirical quantum-chemical methods are published.

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