The performance of exchange—correlation functionals in describing electron density parameters of saddle point structures along chemical reactions
Gabriel Kossaka Macedo Roberto Luiz Andrade Haiduke
Journal of Computational Chemistry Hoboken: John Wiley & Sons, Inc. p.1-9, 2022Hoboken 2022
Localização: IQSC - Inst. Química de São Carlos (P20061 )(Acessar)
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