Data for: Accuracy of hybrid functionals with non-self-consistent Kohn-Sham orbitals for predicting the properties of semiconductors

David S D Gunn (Contributor)
Jonathan Skelton (Creator)
Stephen Parker (Contributor)
Sebastian Metz (Contributor)

Computational and Theoretical Chemistry

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2020
Accuracy of hybrid functionals with non-self-consistent Kohn-Sham orbitals for predicting the properties of semiconductors
Skelton, J., Gunn, D. S. D., Metz, S. & Parker, S. C., 5 May 2020, (Accepted/In press) In: Journal of Chemical Theory and Computation.
Research output: Contribution to journal › Article › peer-review