Zobrazeno 1 - 2
of 2
pro vyhledávání: '"Egalisation du potentiel chimique"'
Autor:
Sukhomlinov, Sergey
Publikováno v:
Theoretical and/or physical chemistry. Université Lille1-Sciences et Technologies, 2012. English
Theoretical and/or physical chemistry. Université Lille1-Sciences et Technologies, 2012. English. ⟨NNT : ⟩
Theoretical and/or physical chemistry. Université Lille1-Sciences et Technologies, 2012. English. ⟨NNT : ⟩
The effective interatomic potential model (force field) for the atomistic modeling of oxide materials was developed with the extensive use of ab initio density functional calculations. The force field represents the total potential energy of system a
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=dedup_wf_001::0661cbd206858d19ca68552239c8280a
https://hal.archives-ouvertes.fr/tel-01263155/file/50376-2012-Sukhomlinov.pdf
https://hal.archives-ouvertes.fr/tel-01263155/file/50376-2012-Sukhomlinov.pdf
Autor:
Sukhomlinov, Sergey
Publikováno v:
Theoretical and/or physical chemistry. Université Lille1-Sciences et Technologies, 2012. English
The effective interatomic potential model (force field) for the atomistic modeling of oxide materials was developed with the extensive use of ab initio density functional calculations. The force field represents the total potential energy of system a
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=od______2592::0661cbd206858d19ca68552239c8280a
https://hal.archives-ouvertes.fr/tel-01263155/file/50376-2012-Sukhomlinov.pdf
https://hal.archives-ouvertes.fr/tel-01263155/file/50376-2012-Sukhomlinov.pdf