S. I. Simak A. E. / Cambridge University Press / B. Johansson A. S. / L. Burakovsky S. P. / TB / DFT / Materials Simulation Laboratory / /
Country
United Kingdom / /
Currency
USD / / /
Event
Business Partnership / /
Facility
American Institute of Physics Downloaded / C. Pike / Technical University of Vienna / American Institute of Physics / /
IndustryTerm
free energy calculations / electronic band energy / transition-metal energetics / harmonic reference systems / free energy / free energy difference / energy term depending / transition-metal series / energy difference / energy differences / cohesive energy / energy shifts / energy / metal / energy contribution / d-band bonding energy / free energy results / energy eigenstate / chemical element / internal energy / lowest and highest energy levels / simplest total-energy model / free energy differences / band free energy / band energy / /
NaturalFeature
S. Duffy river / Duffy river / T. river / T. S. river / R. J. Hemley river / T. S. Duffy river / S. river / M. L. river / /
OperatingSystem
Fermi / DOS / /
Organization
Cambridge University / American Institute of Physics / Department of Earth Sciences / Department of Physics and Astronomy / U.S. Securities and Exchange Commission / United Kingdom London Centre for Nanotechnology / Federal Communications Commission / University of Vienna / /
Person
L. H. Yang / M. Ross / M. Somayazulu / H. K. Mao / R. Ditz / B. Schwager / R. Boehler / D. Errandonea / C. Gessman / Hugoniot / D. Häusermann / /
Position
Prime Minister / model / without d-band bonding / melting pressure Pm / canonical d-band TB model / without sp bands / model for rare gases / D. J. / /
THE JOURNAL OF CHEMICAL PHYSICS 130, 174707 共2009兲 Melting properties of a simple tight-binding model of transition metals. I. The region of half-filled d-band C. Cazorla,1,2,3,a兲 D. Alfè,1,2,3,4 and M. J. Gillan