PHASECALC: A code for the calculation of pseudobinary phase diagrams using no adjustable parameters
Pseudobinary phase diagrams are often used in the analysis of ternary semiconductor compounds of the form B 1− x A x C where A, B and C are the pure elements and 0⩽ x⩽1. The code PHASECALC is used for the calculation of pseudobinary phase diagrams. The code utilizes the Stringfellow method, and a mo...
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Veröffentlicht in: | Computer physics communications 2003-06, Vol.153 (2), p.227-232 |
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Format: | Artikel |
Sprache: | eng |
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Zusammenfassung: | Pseudobinary phase diagrams are often used in the analysis of ternary semiconductor compounds of the form B
1−
x
A
x
C where A, B and C are the pure elements and 0⩽
x⩽1. The code PHASECALC is used for the calculation of pseudobinary phase diagrams. The code utilizes the Stringfellow method, and a modification of this method, to perform this calculation using no adjustable parameters. PHASECALC computes the temperature dependent solidus and liquidus lines as a function of mole fraction
x. PHASECALC requires the following input data: enthalpy of fusion, melting temperature, and lattice constant for the pure binary compounds (AB and BC), electronegativity, molecular weight, density and energy of vaporization for the pure elements A and B. |
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ISSN: | 0010-4655 1879-2944 |
DOI: | 10.1016/S0010-4655(03)00158-9 |