Pressure dependence of ionic polarizabilities in crystals
An analysis is given for the application of different empirical methods and their adaptation in order to study the pressure dependence of ionic polarizabilities of more complex materials than those already studied. Comparison of results shows that upper and lower bounds can be obtained but, for furt...
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Acceso en línea: | https://bibliotecadigital.exactas.uba.ar/collection/paper/document/paper_00201685_v41_n3_p293_Batana http://hdl.handle.net/20.500.12110/paper_00201685_v41_n3_p293_Batana |
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paper:paper_00201685_v41_n3_p293_Batana2023-06-08T14:40:46Z Pressure dependence of ionic polarizabilities in crystals Batana, Alicia Bruno, Jorge Alberto Onofrio An analysis is given for the application of different empirical methods and their adaptation in order to study the pressure dependence of ionic polarizabilities of more complex materials than those already studied. Comparison of results shows that upper and lower bounds can be obtained but, for further precision in the proposals, it would be necessary in the future to overcome the known limitations of ab initio calculations when applied to complex systems at different pressures. Intermediate more sophisticated evaluations in order to guide the study with empirical methods are discussed. © 2005 Pleiades Publishing, Inc. Fil:Batana, A. Universidad de Buenos Aires. Facultad de Ciencias Exactas y Naturales; Argentina. Fil:Bruno, J.A.O. Universidad de Buenos Aires. Facultad de Ciencias Exactas y Naturales; Argentina. 2005 https://bibliotecadigital.exactas.uba.ar/collection/paper/document/paper_00201685_v41_n3_p293_Batana http://hdl.handle.net/20.500.12110/paper_00201685_v41_n3_p293_Batana |
institution |
Universidad de Buenos Aires |
institution_str |
I-28 |
repository_str |
R-134 |
collection |
Biblioteca Digital - Facultad de Ciencias Exactas y Naturales (UBA) |
description |
An analysis is given for the application of different empirical methods and their adaptation in order to study the pressure dependence of ionic polarizabilities of more complex materials than those already studied. Comparison of results shows that upper and lower bounds can be obtained but, for further precision in the proposals, it would be necessary in the future to overcome the known limitations of ab initio calculations when applied to complex systems at different pressures. Intermediate more sophisticated evaluations in order to guide the study with empirical methods are discussed. © 2005 Pleiades Publishing, Inc. |
author |
Batana, Alicia Bruno, Jorge Alberto Onofrio |
spellingShingle |
Batana, Alicia Bruno, Jorge Alberto Onofrio Pressure dependence of ionic polarizabilities in crystals |
author_facet |
Batana, Alicia Bruno, Jorge Alberto Onofrio |
author_sort |
Batana, Alicia |
title |
Pressure dependence of ionic polarizabilities in crystals |
title_short |
Pressure dependence of ionic polarizabilities in crystals |
title_full |
Pressure dependence of ionic polarizabilities in crystals |
title_fullStr |
Pressure dependence of ionic polarizabilities in crystals |
title_full_unstemmed |
Pressure dependence of ionic polarizabilities in crystals |
title_sort |
pressure dependence of ionic polarizabilities in crystals |
publishDate |
2005 |
url |
https://bibliotecadigital.exactas.uba.ar/collection/paper/document/paper_00201685_v41_n3_p293_Batana http://hdl.handle.net/20.500.12110/paper_00201685_v41_n3_p293_Batana |
work_keys_str_mv |
AT batanaalicia pressuredependenceofionicpolarizabilitiesincrystals AT brunojorgealbertoonofrio pressuredependenceofionicpolarizabilitiesincrystals |
_version_ |
1768543735535108096 |