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Chaitanya Deo
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Cooperativity among defect sites in A O 2+ x and A 4 O 9 (A= U, Np, Pu): Density functional calculations
DA Andersson, J Lezama, BP Uberuaga, C Deo, SD Conradson
Physical Review B 79 (2), 024110, 2009
1632009
First principles calculations of the structure and elastic constants of α, β and γ uranium
B Beeler, C Deo, M Baskes, M Okuniewski
Journal of nuclear materials 433 (1-3), 143-151, 2013
902013
Role of di-interstitial clusters in oxygen transport in UO 2+ x from first principles
DA Andersson, T Watanabe, C Deo, BP Uberuaga
Physical Review B 80 (6), 060101, 2009
772009
First principles calculations for defects in U
B Beeler, B Good, S Rashkeev, C Deo, M Baskes, M Okuniewski
Journal of Physics: Condensed Matter 22 (50), 505703, 2010
702010
Synergistic effects in hydrogen–helium bubbles
E Hayward, C Deo
Journal of Physics: Condensed Matter 24 (26), 265402, 2012
622012
Modeling and simulation of irradiation hardening in structural ferritic steels for advanced nuclear reactors
C Deo, C Tomé, R Lebensohn, S Maloy
Journal of nuclear materials 377 (1), 136-140, 2008
582008
Helium bubble nucleation in bcc iron studied by kinetic Monte Carlo simulations
CS Deo, MA Okuniewski, SG Srivilliputhur, SA Maloy, MI Baskes, ...
Journal of nuclear materials 361 (2-3), 141-148, 2007
542007
Energetics of small hydrogen–vacancy clusters in bcc iron
E Hayward, C Deo
Journal of Physics: Condensed Matter 23 (42), 425402, 2011
482011
Models and simulations of nuclear fuel materials properties
M Stan, JC Ramirez, P Cristea, SY Hu, C Deo, BP Uberuaga, ...
Journal of alloys and compounds 444, 415-423, 2007
482007
Atomistic properties of γ uranium
B Beeler, C Deo, M Baskes, M Okuniewski
Journal of physics: Condensed matter 24 (7), 075401, 2012
452012
Atomistic models to investigate thorium dioxide (ThO2)
RK Behera, CS Deo
Journal of Physics: Condensed Matter 24 (21), 215405, 2012
422012
Stochastic simulation of dislocation glide in tantalum and Ta-based alloys
CS Deo, DJ Srolovitz, W Cai, VV Bulatov
Journal of the Mechanics and Physics of Solids 53 (6), 1223-1247, 2005
412005
The interaction of a screw dislocation with point defects in bcc iron
E Hayward, C Deo, BP Uberuaga, CN Tomé
Philosophical Magazine 92 (22), 2759-2778, 2012
332012
Ferroelectricity and ferromagnetism in EuTiO 3 nanowires
AN Morozovska, MD Glinchuk, RK Behera, B Zaulychny, CS Deo, ...
Physical Review B 84 (20), 205403, 2011
332011
First passage time Markov chain analysis of rare events for kinetic Monte Carlo: double kink nucleation during dislocation glide
CS Deo, DJ Srolovitz
Modelling and Simulation in Materials Science and Engineering 10 (5), 581, 2002
332002
Atomistic modeling of high temperature uranium–zirconium alloy structure and thermodynamics
AP Moore, B Beeler, C Deo, MI Baskes, MA Okuniewski
Journal of Nuclear Materials 467, 802-819, 2015
322015
New multiferroics based on EuxSr1−xTiO3 nanotubes and nanowires
EA Eliseev, MD Glinchuk, VV Khist, CW Lee, CS Deo, RK Behera, ...
Journal of Applied Physics 113 (2), 024107, 2013
302013
Linking atomic and mesoscopic scales for the modelling of the transport properties of uranium dioxide under irradiation
M Bertolus, M Freyss, B Dorado, G Martin, K Hoang, S Maillard, R Skorek, ...
Journal of Nuclear Materials 462, 475-495, 2015
282015
Size-dependent plastic deformation of twinned nanopillars in body-centered cubic tungsten
S Xu, JK Startt, TG Payne, CS Deo, DL McDowell
Journal of Applied Physics 121 (17), 175101, 2017
272017
First-principles calculations of the stability and incorporation of helium, xenon and krypton in uranium
B Beeler, B Good, S Rashkeev, C Deo, M Baskes, M Okuniewski
Journal of nuclear materials 425 (1-3), 2-7, 2012
222012
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