Merli & Pavese - Melting temperature prediction

Published: 27 February 2021| Version 1 | DOI: 10.17632/39yh68zmsh.1
Contributor:
Marcello Merli

Description

The ab-initio data (static energies, Helmoltz free energies, P/T diagrams data, phonon spectrum data and so on) for MgO periclase melting point prediction published in the article by Marcello Merli and Alessandro Pavese "Melting temperature prediction by thermoelastic instability: An ab initio modelling, for periclase (MgO)" - Calphad - 73 2021 - 102259 are deposited.

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Institutions

Universita degli Studi di Palermo

Categories

Ab Initio Calculation, Melting, Stability Prediction, Energy Modelling

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