Hosted by Columbia University and the Flatiron Institute, May 31 - June 3, 2022
Organized by Renata Wentzcovitch, David Reichman, Raquel Queiroz, Timothy Berkelbach, Johannes Flick, hosted by Columbia University and Flatiron Institute
Abstracts presented by Wentzcovitch group
- Poster - Ab initio calculation of third-order elastic constants
- Poster - Spin State and Structural Stability of Ferropericlase up to 30 Mbar
- Poster - pgm: A Python package for free energy calculation
- Poster - A systematic DFT study of thermal properties of several minerals using ab initio workflows
- Poster - Anharmonic thermodynamic properties and phase boundary across the post-perovskite transition in MgSiO3
- Poster - Spin crossover in ferropericlase: beyond ideal solid solution model
- Poster - The post-perovskite transition in Fe- and Al-bearing bridgmanite