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cond-mat.mtrl-sci2022
Carbon phase diagram with empirical and machine learned interatomic potentials
George Marchant, Bora Karasulu, Livia B. Partay
In the present work we detail how the many-body potential energy landscape of interatomic potentials for carbon can be explored by utilising the nested sampling algorithm, allowing…
stat.CO2022★ 158 cited
Nested sampling for physical scientists
Greg Ashton, Noam Bernstein, Johannes Buchner +20
We review Skilling's nested sampling (NS) algorithm for Bayesian inference and more broadly multi-dimensional integration. After recapitulating the principles of NS, we survey deve…