Methods for Melting Temperature Calculation
<p>Melting temperature calculation has important applications in the theoretical study of phase diagrams and computational materials screenings. In this thesis, we present two new methods, i.e., the improved Widom's particle insertion method and the small-cell coexistence method, which we...
Internet
https://thesis.library.caltech.edu/8721/1/Thesis_Hong.pdfHong, Qi-Jun (2015) Methods for Melting Temperature Calculation. Dissertation (Ph.D.), California Institute of Technology. doi:10.7907/Z98C9T6H. https://resolver.caltech.edu/CaltechTHESIS:11092014-074023936 <https://resolver.caltech.edu/CaltechTHESIS:11092014-074023936>