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Calculating free energies of point defects from ab initioComputational Materials Science, (2018)Development and application of a Ni-Ti interatomic potential with high predictive accuracy of the martensitic phase transitionPhysical Review B, 92 (13):
134107 (2015)Ab Initio-Based Prediction of Phase Diagrams: Application to Magnetic Shape Memory AlloysAdvanced Engineering Materials, 14 (8):
547-561 (2012)Impact of local electrostatic field rearrangement on field ionizationJournal of Physics D: Applied Physics, 51 (10):
105601 (2018)The role of metastable LPSO building block clusters in phase transformations of an Mg-Y-Zn alloyActa Materialia, (2016)An insight into using DFT data for Calphad modeling of solid phases in the third generation of Calphad databases, a case study for AlCalphad, (June 2019)Structural anomaly in the high-entropy alloy ZrNbTiTaHfIntermetallics, (2016)Atomistic deformation behavior of single and twin crystalline Cu nanopillars with preexisting dislocationsActa Materialia, (2020)Atomic scale processes of phase transformations in nanocrystalline NiTi shape-memory alloysActa Materialia, (2017)Ab initio thermodynamics of the CoCrFeMnNi high entropy alloy: Importance of entropy contributions beyond the configurational oneActa Materialia, (2015)