Renata M. Wentzcovitch

1. Accurate projected augmented wave (PAW) datasets for rare-earth elements (RE=La-Lu)
   2014/08/05 by Mehmet Topsakal, Renata M. Wentzcovitch, Topsakal, M. +1 · 5 citations
   Chemistry · Materials Science · Physics and Astronomy · #FOS: Physical sciences #Inorganic Chemistry and Materials #Materials Science (cond-mat.mtrl-sci) #Rare-earth and actinide compounds #Solid-state spectroscopy and crystallography
2. Ab initio superionic-liquid phase diagram of Fe1-xOx under Earth's inner core conditions
   2024/10/31 by Zepeng Wu, Gao Chen, Wu, Zepeng +11 · 1 citation
   Earth and Planetary Sciences · #FOS: Physical sciences #Geophysics (physics.geo-ph) #High-pressure geophysics and materials
3. Alchemical thermodynamic integration for ab initio free-energy calculations in solutions
   2026/07/21 by Liangrui Wei, Feng Zhang, Renata M. Wentzcovitch +2
   #cond-mat.mtrl-sci