Calculation of excess free energies of precipitates via direct thermodynamic integration across phase boundaries
Journal article, 2012
Author
B. Sadigh
Paul Erhart
Chalmers, Applied Physics, Materials and Surface Theory
Physical Review B - Condensed Matter and Materials Physics
24699950 (ISSN) 24699969 (eISSN)
Vol. 86 13 134204Subject Categories
Physical Chemistry
Physical Sciences
Other Physics Topics
Condensed Matter Physics
Infrastructure
C3SE (Chalmers Centre for Computational Science and Engineering)
Areas of Advance
Materials Science
DOI
10.1103/PhysRevB.86.134204