856 citations · 1.2k across the 19 of their papers we have counts for
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Multi-physics simulations of lithiation-induced stress in LiTiO electrode particles
Tonghu Jiang, Shiva Rudraraju, Anindya Roy +3
Cubic spinel LiTiO is a promising electrode material as it exhibits a high lithium diffusivity and undergoes minimal changes in lattice parameters during lithia…
Recovering 0 Kelvin Effective Hamiltonian Parameters from High-Temperature Disordered Phases
Elizabeth Decolvenaere, Michael J. Gordon, Anton Van der Ven
Effective Hamiltonians, when used in tandem with statistical mechanics techniques, offer a rigorous connection between 0 Kelvin ab-initio predictions and finite temperature experim…
A comparison of Redlich-Kister polynomial and cubic spline representations of the chemical potential in phase field computations
Gregory H. Teichert, N. S. Harsha Gunda, Shiva Rudraraju +4
Free energies play a central role in many descriptions of equilibrium and non-equilibrium properties of solids. Continuum partial differential equations (PDEs) of atomic transport,…