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Published in 2021 at "Geochimica et Cosmochimica Acta"
DOI: 10.1016/j.gca.2021.03.015
Abstract: Abstract We present first principles predictions of the absolute entropy of a silicate liquid (CaSiO3) over a wide pressure-temperature range encompassing the Earth’s mantle (2000-6000 K, 0-270 GPa). The results are derived from molecular dynamics…
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Keywords:
dynamics freezing;
casio3;
liquid;
entropy ... See more keywords