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2 articles related to "Wannier Functions"

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Articles

Original Research

Published on 26 Feb 2026

Symmetry, bonding, and wannier function construction in the PF6− molecule: a first-principles case study

in Condensed Matter Physics

Paul M. Masanja
Esther J. Tarimo
P. V. Kanaka Rao
Vijay Singh
Bernard Mwankemwa
Javier Junquera

Frontiers in Physics

doi 10.3389/fphy.2026.1764641

128 views

Perspective

Published on 21 Dec 2018

Sensitivity to Dispersion Forces in First-Principles Modeling of Disordered Chalcogenides

in Ceramics and Glass

Carlo Massobrio
Evelyne Martin
Ziyad Chaker
Mauro Boero
Assil Bouzid
Sébastien Le Roux
Guido Ori

Frontiers in Materials

doi 10.3389/fmats.2018.00078

2,838 views
8 citations