Jx: An open-source software for calculating magnetic interactions based on magnetic force theory

Cited 0 time in webofscience Cited 0 time in scopus
  • Hit : 69
  • Download : 0
DC FieldValueLanguage
dc.contributor.authorYoon, Hongkeeko
dc.contributor.authorKim, Taek Jungko
dc.contributor.authorSim, Jae-Hoonko
dc.contributor.authorHan, Myung Joonko
dc.date.accessioned2019-12-13T01:20:36Z-
dc.date.available2019-12-13T01:20:36Z-
dc.date.created2019-12-06-
dc.date.created2019-12-06-
dc.date.created2019-12-06-
dc.date.issued2020-02-
dc.identifier.citationCOMPUTER PHYSICS COMMUNICATIONS, v.247, pp.106927-
dc.identifier.issn0010-4655-
dc.identifier.urihttp://hdl.handle.net/10203/268742-
dc.description.abstractWe describe our newly-developed open-source software, named by Jx, to perform magnetic force linear response calculations. Jx is a user-friendly and efficient tool to calculate magnetic interaction in solids and molecules. Without supercell calculation, it computes both short- and long-range interactions. It is also possible to calculate an orbital-resolved matrix form of magnetic couplings. Functionality and formalism are presented with examples. The program architecture and parallel algorithm are also described. Program summary: Program Title: Jx Program Files doi: http://dx.doi.org/10.17632/kg5x95gwgj.1 Licensing provisions: LGPL Programming language: Julia Nature of problem: The first-principles estimation of magnetic interaction in solids and molecules. Solution method: Calculate the magnetic coupling constant based on magnetic force response theory.-
dc.languageEnglish-
dc.publisherELSEVIER-
dc.titleJx: An open-source software for calculating magnetic interactions based on magnetic force theory-
dc.typeArticle-
dc.identifier.wosid000503093400027-
dc.identifier.scopusid2-s2.0-85072604711-
dc.type.rimsART-
dc.citation.volume247-
dc.citation.beginningpage106927-
dc.citation.publicationnameCOMPUTER PHYSICS COMMUNICATIONS-
dc.identifier.doi10.1016/j.cpc.2019.106927-
dc.contributor.localauthorHan, Myung Joon-
dc.contributor.nonIdAuthorYoon, Hongkee-
dc.description.isOpenAccessN-
dc.type.journalArticleArticle-
dc.subject.keywordAuthorMagnetic interaction-
dc.subject.keywordAuthorDensity functional theory-
dc.subject.keywordAuthorMagnetic force theory-
dc.subject.keywordPlusEXCHANGE INTERACTIONS-
Appears in Collection
PH-Journal Papers(저널논문)
Files in This Item
There are no files associated with this item.

qr_code

  • mendeley

    citeulike


rss_1.0 rss_2.0 atom_1.0