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pro vyhledávání: '"Stanek, CR"'
Parametrization of LSDA plus U for noncollinear magnetic configurations: Multipolar magnetism in UO2
To explore the formation of noncollinear magnetic configurations in materials with strongly correlated electrons, we derive a noncollinear LSDA + U model involving only one parameter U , as opposed to the difference between the Hubbard and Stoner par
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=od______1032::7d41d92ccc20d0436fda03ebbcb88935
http://hdl.handle.net/10044/1/101229
http://hdl.handle.net/10044/1/101229
Molecular dynamics simulations have been conducted to study the effects of dislocations and grain boundaries on He diffusion in UO2. Calculations were carried out for the {100}, {110} and {111} h110i edge dislocations, the screw h110i dislocation and
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=od______1032::e818011ece579ad06b82e4aef4e95745
http://hdl.handle.net/10044/1/38591
http://hdl.handle.net/10044/1/38591
Autor:
Liu, X-Y, Cooper, MWD, McClellan, KJ, Lashley, JC, Byler, DD, Bell, BDC, Grimes, RW, Stanek, CR, Andersson, DA
Uranium dioxide (UO₂) is the most commonly used fuel in light-water nuclear reactors and thermal conductivity controls the removal of heat produced by fission, thereby governing fuel temperature during normal and accident conditions. The use of fue
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=od______1032::589b76e2d5e31f90a20ca74e770b98f6
http://hdl.handle.net/10044/1/57576
http://hdl.handle.net/10044/1/57576
Autor:
Sabagh Moeini, Alireza1 (AUTHOR), Shariatmadar Tehrani, Fatemeh1 (AUTHOR) f_tehrani@semnan.ac.ir, Naeimi-Sadigh, Alireza2 (AUTHOR)
Publikováno v:
Scientific Reports. 11/5/2024, Vol. 14 Issue 1, p1-13. 13p.
Autor:
Liu XY; Materials Science and Technology Division, Los Alamos National Laboratory, Los Alamos, New Mexico 87545, United States., Pilania G; Materials Science and Technology Division, Los Alamos National Laboratory, Los Alamos, New Mexico 87545, United States., Talapatra AA; Materials Science and Technology Division, Los Alamos National Laboratory, Los Alamos, New Mexico 87545, United States., Stanek CR; Materials Science and Technology Division, Los Alamos National Laboratory, Los Alamos, New Mexico 87545, United States., Uberuaga BP; Materials Science and Technology Division, Los Alamos National Laboratory, Los Alamos, New Mexico 87545, United States.
Publikováno v:
ACS applied materials & interfaces [ACS Appl Mater Interfaces] 2020 Oct 14; Vol. 12 (41), pp. 46296-46305. Date of Electronic Publication: 2020 Sep 30.
Autor:
Pilania G; Materials Science and Technology Division, Los Alamos National Laboratory, Los Alamos, New Mexico 87545, USA., McClellan KJ; Materials Science and Technology Division, Los Alamos National Laboratory, Los Alamos, New Mexico 87545, USA., Stanek CR; Materials Science and Technology Division, Los Alamos National Laboratory, Los Alamos, New Mexico 87545, USA., Uberuaga BP; Materials Science and Technology Division, Los Alamos National Laboratory, Los Alamos, New Mexico 87545, USA.
Publikováno v:
The Journal of chemical physics [J Chem Phys] 2018 Jun 28; Vol. 148 (24), pp. 241729.
Autor:
Jaime M; MPA-CMMS, Los Alamos National Laboratory, Los Alamos, NM, 87545, USA. mjaime@lanl.gov., Saul A; Aix-Marseille University, CINaM-CNRS UMR 7325 Campus de Luminy, Marseille cedex 9, 13288, France. saul@cinam.univ-mrs.fr., Salamon M; MPA-CMMS, Los Alamos National Laboratory, Los Alamos, NM, 87545, USA., Zapf VS; MPA-CMMS, Los Alamos National Laboratory, Los Alamos, NM, 87545, USA., Harrison N; MPA-CMMS, Los Alamos National Laboratory, Los Alamos, NM, 87545, USA., Durakiewicz T; MPA-CMMS, Los Alamos National Laboratory, Los Alamos, NM, 87545, USA.; Institute of Physics, Maria Curie-Sklodowska University, PL-20-031, Lublin, Poland., Lashley JC; MPA-11, Institute for Materials Science, Los Alamos National Laboratory, Los Alamos, NM, 87545, USA., Andersson DA; MST-8, Los Alamos National Laboratory, Los Alamos, NM, 87545, USA., Stanek CR; MST-8, Los Alamos National Laboratory, Los Alamos, NM, 87545, USA., Smith JL; Sigma Division, Los Alamos National Laboratory, Los Alamos, NM, 87545, USA., Gofryk K; Idaho National Laboratory, Idaho Falls, ID, 83415, USA. krzysztof.gofryk@inl.gov.
Publikováno v:
Nature communications [Nat Commun] 2017 Jul 24; Vol. 8 (1), pp. 99. Date of Electronic Publication: 2017 Jul 24.
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