Critical assessment of UO2 classical potentials for thermal conductivity calculations

Phonon-Mediated Thermal Conductivity in Ionic Solids by Lattice Dynamics-Based Methods

(2011) Aleksandr Chernatynskiy et al.   JOURNAL OF THE AMERICAN CERAMIC SOCIETY

Elastic constants, phonon density of states, and thermal properties of UO2

(2011) M. Sanati et al.   PHYSICAL REVIEW B

Derivation of enhanced potentials for uranium dioxide and the calculation of lattice and intrinsic defect properties

(2010) Mark S.D. Read et al.   JOURNAL OF NUCLEAR MATERIALS

Diffusion of helium in non-stoichiometric uranium dioxide

(2010) E. Yakub et al.   JOURNAL OF NUCLEAR MATERIALS

Evaluation of computational techniques for solving the Boltzmann transport equation for lattice thermal conductivity calculations

(2010) Aleksandr Chernatynskiy et al.   PHYSICAL REVIEW B

Second-generation charge-optimized many-body potential forSi/SiO2and amorphous silica

(2010) Tzu-Ray Shan et al.   PHYSICAL REVIEW B

First-principles study of defects and phase transition in UO2

(2009) Jianguo Yu et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

Ab initioconstruction of interatomic potentials for uranium dioxide across all interatomic distances

(2009) P. Tiwary et al.   PHYSICAL REVIEW B

Assessing the applicability of quantum corrections to classical thermal conductivity predictions

(2009) J. E. Turney et al.   PHYSICAL REVIEW B

Ab initiotheory of the lattice thermal conductivity in diamond

(2009) A. Ward et al.   PHYSICAL REVIEW B

Stress-induced phase transformation in nanocrystalline UO2

(2009) Tapan G. Desai et al.   SCRIPTA MATERIALIA

Atomistic modeling of the vibrational and thermodynamic properties of uranium dioxide, UO2

(2008) Prabhatasree Goel et al.   JOURNAL OF NUCLEAR MATERIALS

Thermal transport properties of uranium dioxide by molecular dynamics simulations

(2008) Taku Watanabe et al.   JOURNAL OF NUCLEAR MATERIALS