TB2J: a python package for computing magnetic interaction parameters

He, Xu; Helbig, Nicole; Verstraete, Matthieu; Bousquet, Eric

doi:10.1016/j.cpc.2021.107938

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TB2J: a python package for computing magnetic interaction parameters

He, Xu; Helbig, Nicole; Verstraete, Matthieu et al.

2021 • In Computer Physics Communications, p. 107938

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https://hdl.handle.net/2268/259033

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10.1016/j.cpc.2021.107938

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Keywords :

CECI

Research center :

CESAM - Complex and Entangled Systems from Atoms to Materials - ULiège

Disciplines :

Physics

Author, co-author :

He, Xu

Helbig, Nicole ; Université de Liège - ULiège > Département de physique > Physique des matériaux et nanostructures

Verstraete, Matthieu ; Université de Liège - ULiège > Département de physique > Physique des matériaux et nanostructures

Bousquet, Eric ; Université de Liège - ULiège > Département de physique > Physique théorique des matériaux

Language :

English

Title :

TB2J: a python package for computing magnetic interaction parameters

Publication date :

2021

Journal title :

Computer Physics Communications

ISSN :

0010-4655

eISSN :

1879-2944

Publisher :

North-Holland

Pages :

107938

Peer reviewed :

Peer Reviewed verified by ORBi

Funders :

F.R.S.-FNRS - Fonds de la Recherche Scientifique [BE]

Available on ORBi :

since 21 April 2021

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