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Determination of Krypton Diffusion Coefficients in Uranium Dioxide Using Atomic Scale Calculations.
Inorg Chem. 2017 Jan 3;56(1):125-137. doi: 10.1021/acs.inorgchem.6b01560. Epub 2016 Dec 16.
Inorg Chem. 2017.
PMID: 27983828
Electronic Structure Investigation of the Bulk Properties of Uranium-Plutonium Mixed Oxides (U, Pu)O2.
Njifon IC, Bertolus M, Hayn R, Freyss M.
Njifon IC, et al. Among authors: freyss m.
Inorg Chem. 2018 Sep 4;57(17):10974-10983. doi: 10.1021/acs.inorgchem.8b01561. Epub 2018 Aug 14.
Inorg Chem. 2018.
PMID: 30106281
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DFT + U investigation of charged point defects and clusters in UO2.
Vathonne E, Wiktor J, Freyss M, Jomard G, Bertolus M.
Vathonne E, et al. Among authors: freyss m.
J Phys Condens Matter. 2014 Aug 13;26(32):325501. doi: 10.1088/0953-8984/26/32/325501. Epub 2014 Jul 17.
J Phys Condens Matter. 2014.
PMID: 25031239
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Advances in first-principles modelling of point defects in UO2: f electron correlations and the issue of local energy minima.
Dorado B, Freyss M, Amadon B, Bertolus M, Jomard G, Garcia P.
Dorado B, et al. Among authors: freyss m.
J Phys Condens Matter. 2013 Aug 21;25(33):333201. doi: 10.1088/0953-8984/25/33/333201. Epub 2013 Jul 29.
J Phys Condens Matter. 2013.
PMID: 23893864
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Structural, electronic and energetic properties of uranium-americium mixed oxides [Formula: see text] using DFT[Formula: see text] calculations.
Talla Noutack MS, Jomard G, Freyss M, Geneste G.
Talla Noutack MS, et al. Among authors: freyss m.
J Phys Condens Matter. 2019 Dec 4;31(48):485501. doi: 10.1088/1361-648X/ab395e. Epub 2019 Aug 7.
J Phys Condens Matter. 2019.
PMID: 31390598
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Noncollinear order contribution to the exchange coupling in Fe/Cr(001) superlattices.
Freyss M, Stoeffler D, Dreyssé H.
Freyss M, et al.
Phys Rev B Condens Matter. 1996 Nov 1;54(18):R12677-R12680. doi: 10.1103/physrevb.54.r12677.
Phys Rev B Condens Matter. 1996.
PMID: 9985217
No abstract available.
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