Effectiveness of smearing and tetrahedron methods: best practices in DFT codes
Jorgensen, Jeremy J, Hart, Gus L W
Published in Modelling and simulation in materials science and engineering (01.09.2021)
Published in Modelling and simulation in materials science and engineering (01.09.2021)
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Journal Article
A robust algorithm for k-point grid generation and symmetry reduction
Hart, Gus L W, Jorgensen, Jeremy J, Morgan, Wiley S, Forcade, Rodney W
Published in Journal of physics communications (01.06.2019)
Published in Journal of physics communications (01.06.2019)
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Journal Article
Efficiency of Generalized Regular k-point grids
Morgan, Wiley S., Jorgensen, Jeremy J., Hess, Bret C., Hart, Gus L.W.
Published in Computational materials science (01.10.2018)
Published in Computational materials science (01.10.2018)
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Journal Article
Effectiveness of smearing and tetrahedron methods: best practices in DFT codes
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Paper
Journal Article
A general algorithm for calculating irreducible Brillouin zones
Jorgensen, Jeremy J, Christensen, John E, Jarvis, Tyler J, Hart, Gus L W
Published in arXiv.org (23.01.2022)
Published in arXiv.org (23.01.2022)
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Paper
Journal Article
A robust algorithm for $k$-point grid generation and symmetry reduction
Hart, Gus L. W, Jorgensen, Jeremy J, Morgan, Wiley S, Forcade, Rodney W
Year of Publication 26.09.2018
Year of Publication 26.09.2018
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Journal Article
Efficiency of Generalized Regular k-point Grids
Morgan, Wiley S, Jorgensen, Jeremy J, Hess, Bret C, Hart, Gus L W
Published in arXiv.org (25.06.2018)
Published in arXiv.org (25.06.2018)
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Paper
Journal Article
Generalized Regular k-point Grid Generation On The Fly
Morgan, Wiley S, Christensen, John E, Hamilton, Parker K, Jorgensen, Jeremy J, Campbell, Branton J, Hart, Gus L. W, Forcade, Rodney W
Year of Publication 08.02.2019
Year of Publication 08.02.2019
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Journal Article
A robust algorithm for \(k\)-point grid generation and symmetry reduction
Hart, Gus L W, Jorgensen, Jeremy J, Morgan, Wiley S, cade, Rodney W
Published in arXiv.org (27.06.2019)
Published in arXiv.org (27.06.2019)
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