Facultad de Química
Centro
University of York
York, Reino UnidoPublicaciones en colaboración con investigadoras/es de University of York (12)
2023
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Generalised Form of the Magnetic Anisotropy Field in Micromagnetic and Atomistic Spin Models
2023 IEEE International Magnetic Conference - Short Papers, INTERMAG Short Papers 2023 - Proceedings
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Generalized form of the magnetic anisotropy field in micromagnetic and atomistic spin models
Physical Review B, Vol. 107, Núm. 6
2020
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Si-C(sp3) bond activation through oxidative addition at a Rh(i) centre
Dalton Transactions, Vol. 49, Núm. 17, pp. 5416-5419
2009
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ABINIT: First-principles approach to material and nanosystem properties
Computer Physics Communications, Vol. 180, Núm. 12, pp. 2582-2615
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Coercive field and energy barriers in partially disordered FePt nanoparticles
Journal of Applied Physics, Vol. 105, Núm. 7
2008
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Sharing electronic structure and crystallographic data with ETSF_IO
Computer Physics Communications, Vol. 179, Núm. 10, pp. 748-758
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Specification of an extensible and portable file format for electronic structure and crystallographic data
Computational Materials Science, Vol. 43, Núm. 4, pp. 1056-1065
2004
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Comment on "band-gap problem in semiconductors revisited: Effects of core states and many-body self-consistency"
Physical Review Letters
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Long-range contribution to the exchange-correlation kernel of time-dependent density functional theory
Physical Review B - Condensed Matter and Materials Physics, Vol. 69, Núm. 15
2002
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Interactions and hysteresis behaviour of Fe/SiO2 nanocomposites
Journal of Magnetism and Magnetic Materials, Vol. 242-245, pp. 1103-1105
2000
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Enhancements to the GW space-time method
Computer Physics Communications, Vol. 125, Núm. 1, pp. 105-118