Thermodynamic modeling, Uncertainty quantification, Modified quasichemical model in quadruplet approximation, Open-source software, Extensible markup language, PyCalphad and ESPEI
Molten Salts, Cesium, Iodine, MSRs, Phase Equilibria, MQMQA
Yb-Sb system, CALPHAD, Phonon, First-principles calculations, Thermoelectrics
FLiNaK, Molten Salts, First-principles calculations, Phonon, AIMD, CALPHAD modeling