"The reliability of DFT methods to predict electronic structures and ..."

Kun Liu et al. (2014)

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DOI: 10.1002/JCC.23535

access: closed

type: Journal Article

metadata version: 2020-05-30

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Kun Liu, Yu-Xue Li, Jia-Ling Su, Bin Wang:
The reliability of DFT methods to predict electronic structures and minimum energy crossing point for [Fe^IVO](OH)₂ models: A comparison study with MCQDPT method. J. Comput. Chem. 35(9): 703-710 (2014)

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