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Page 1
Compact A15 Frank-Kasper nano-phases at the origin of dislocation loops in face-centred cubic metals.
Nat Commun. 2023 May 25;14(1):3003. doi: 10.1038/s41467-023-38729-6.
Nat Commun. 2023.
PMID: 37230966
Free PMC article.
Migration energy of He in W revisited by ab initio calculations.
Becquart CS, Domain C.
Becquart CS, et al. Among authors: domain c.
Phys Rev Lett. 2006 Nov 10;97(19):196402. doi: 10.1103/PhysRevLett.97.196402. Epub 2006 Nov 10.
Phys Rev Lett. 2006.
PMID: 17155647
Item in Clipboard
Simulation of screw dislocation motion in iron by molecular dynamics simulations.
Domain C, Monnet G.
Domain C, et al.
Phys Rev Lett. 2005 Nov 18;95(21):215506. doi: 10.1103/PhysRevLett.95.215506. Epub 2005 Nov 17.
Phys Rev Lett. 2005.
PMID: 16384158
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Density functional theory analysis of the structural and electronic properties of TiO2 rutile and anatase polytypes: performances of different exchange-correlation functionals.
Labat F, Baranek P, Domain C, Minot C, Adamo C.
Labat F, et al. Among authors: domain c.
J Chem Phys. 2007 Apr 21;126(15):154703. doi: 10.1063/1.2717168.
J Chem Phys. 2007.
PMID: 17461655
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Uranyl ion interaction at the water/NiO(100) interface: a predictive investigation by first-principles molecular dynamic simulations.
Sebbari K, Roques J, Domain C, Simoni E.
Sebbari K, et al. Among authors: domain c.
J Chem Phys. 2012 Oct 28;137(16):164701. doi: 10.1063/1.4759506.
J Chem Phys. 2012.
PMID: 23126731
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Theoretical investigation of the uranyl ion sorption on the rutile TiO2(110) face.
Perron H, Roques J, Domain C, Drot R, Simoni E, Catalette H.
Perron H, et al. Among authors: domain c.
Inorg Chem. 2008 Dec 1;47(23):10991-7. doi: 10.1021/ic801246k.
Inorg Chem. 2008.
PMID: 18973289
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Periodic density functional theory investigation of the uranyl ion sorption on the TiO2 rutile (110) face.
Perron H, Domain C, Roques J, Drot R, Simoni E, Catalette H.
Perron H, et al. Among authors: domain c.
Inorg Chem. 2006 Aug 21;45(17):6568-70. doi: 10.1021/ic0603914.
Inorg Chem. 2006.
PMID: 16903702
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