Computational thermochemistry: Automated generation of scale factors for vibrational frequencies calculated by electronic structure model chemistries

Haoyu S. Yu, Lucas J. Fiedler, I. M. Alecu, Donald G. Truhlar

Research output: Contribution to journal › Article › peer-review

16 Scopus citations

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Chemistry

Engineering

Computer Science

Physics

Biochemistry, Genetics and Molecular Biology