TY  - RPRT
TI  - Density-Functional Tight-Binding Parameters for Bulk Zirconium: A Case Study for Repulsive Potentials
AU  - Hutama, Aulia Sukma
AU  - Chou, Chien-pin
AU  - Nishimura, Yoshifumi
AU  - Witek, Henryk A.
AU  - Irle, Stephan
PY  - 2021
DO  - 10.1021/acs.jpca.0c11178
UR  - https://www.osti.gov/biblio/1777751
ID  - 1777751
ER  -