Hf2Ni compound investigation: Electronic structure and electric field gradient
Abstract
The electronic structure of the Hf2Ni intermetallic compound has been obtained using the first-principle full-potential (FP) linear-muffin- tin-orbital (LMTO) method in the atomic-sphere approximation (ASA). The electric field gradient (EFG) tensor is calculated for both Hf and Ni sites and compared with the experiment. The theoretical results show that the EFG is determined dominantly by the p electrons.
Keywords:
electronic structure / hyperfine interactionsSource:
Solid State Phenomena, 1998, 61-2, 155-158
DOI: 10.4028/www.scientific.net/SSP.61-62.155
ISSN: 1012-0394
WoS: 000075589100027
Scopus: 2-s2.0-0031632098
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Institution/Community
VinčaTY - JOUR AU - Lalić, Milan V. AU - Popović, Zoran S. AU - Vukajlović, Filip R. PY - 1998 UR - https://vinar.vin.bg.ac.rs/handle/123456789/2176 AB - The electronic structure of the Hf2Ni intermetallic compound has been obtained using the first-principle full-potential (FP) linear-muffin- tin-orbital (LMTO) method in the atomic-sphere approximation (ASA). The electric field gradient (EFG) tensor is calculated for both Hf and Ni sites and compared with the experiment. The theoretical results show that the EFG is determined dominantly by the p electrons. T2 - Solid State Phenomena T1 - Hf2Ni compound investigation: Electronic structure and electric field gradient VL - 61-2 SP - 155 EP - 158 DO - 10.4028/www.scientific.net/SSP.61-62.155 ER -
@article{ author = "Lalić, Milan V. and Popović, Zoran S. and Vukajlović, Filip R.", year = "1998", abstract = "The electronic structure of the Hf2Ni intermetallic compound has been obtained using the first-principle full-potential (FP) linear-muffin- tin-orbital (LMTO) method in the atomic-sphere approximation (ASA). The electric field gradient (EFG) tensor is calculated for both Hf and Ni sites and compared with the experiment. The theoretical results show that the EFG is determined dominantly by the p electrons.", journal = "Solid State Phenomena", title = "Hf2Ni compound investigation: Electronic structure and electric field gradient", volume = "61-2", pages = "155-158", doi = "10.4028/www.scientific.net/SSP.61-62.155" }
Lalić, M. V., Popović, Z. S.,& Vukajlović, F. R.. (1998). Hf2Ni compound investigation: Electronic structure and electric field gradient. in Solid State Phenomena, 61-2, 155-158. https://doi.org/10.4028/www.scientific.net/SSP.61-62.155
Lalić MV, Popović ZS, Vukajlović FR. Hf2Ni compound investigation: Electronic structure and electric field gradient. in Solid State Phenomena. 1998;61-2:155-158. doi:10.4028/www.scientific.net/SSP.61-62.155 .
Lalić, Milan V., Popović, Zoran S., Vukajlović, Filip R., "Hf2Ni compound investigation: Electronic structure and electric field gradient" in Solid State Phenomena, 61-2 (1998):155-158, https://doi.org/10.4028/www.scientific.net/SSP.61-62.155 . .