Calculation outputs for Electronic and Vibrational Properties of TiS2, ZrS2, and HfS2 by hybrid DFT methods

Nina Glebko (Creator)
Antti Karttunen (Creator)

Dataset

1 Article

1 results

2018
Electronic and Vibrational Properties of TiS2, ZrS2, and HfS2: Periodic Trends Studied by Dispersion-Corrected Hybrid Density Functional Methods
Glebko, N., Aleksandrova, I., Tewari, G. C., Tripathi, T. S., Karppinen, M. & Karttunen, A. J., 29 Nov 2018, In: Journal of Physical Chemistry C. 122, 47, p. 26835-26844 10 p.
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