Articles with "study thermodynamic" as a keyword



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Experimental Study and Thermodynamic Calculations of the Distribution of Ag, Au, Bi, and Zn Between Pb Metal and Pb–Fe–O–Si slag

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Published in 2019 at "Journal of Sustainable Metallurgy"

DOI: 10.1007/s40831-019-00257-3

Abstract: The present article continues the series reviewing the thermochemistry of complex multicomponent pyrometallurgical systems. The recovery of multiple metals through the Pb-based primary and recycling processes is an economic driving force for the circular economy… read more here.

Keywords: experimental study; study thermodynamic; study; metal ... See more keywords
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Ab initio study and thermodynamic modeling of the Pd-Si-C system

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Published in 2020 at "Computational Materials Science"

DOI: 10.1016/j.commatsci.2019.109238

Abstract: Abstract Understanding phase stability in the Pd-Si-C ternary system is important for predicting the high-temperature behavior of tristructural isotropic (TRISO) nuclear fuels for high-temperature gas-cooled reactors. Here, we employ ab initio evolutionary search to predict… read more here.

Keywords: system; study thermodynamic; initio; initio study ... See more keywords
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Molecular dynamics study of the thermodynamic and kinetic properties of the solid-liquid interface in FeMn

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Published in 2020 at "Computational Materials Science"

DOI: 10.1016/j.commatsci.2020.109773

Abstract: Abstract The solid-liquid phase equilibria as a function of temperature and composition has been computed for the Fe-Mn system using a semi-grand canonical Monte Carlo technique. Interaction between atoms were modeled using a second nearest… read more here.

Keywords: dynamics study; thermodynamic kinetic; study thermodynamic; molecular dynamics ... See more keywords