Results 51 to 53 of about 142 (53)

Influence of electron correlation on the ground-state properties of cerium dioxide [PDF]

open access: yes, 2006
Paulus, B., Voloshina, E.
core   +1 more source
Some of the next articles are maybe not open access.

Calculating Elastic Constants of Molecular Crystals Using Crystal98

AIP Conference Proceedings, 2004
Calculations of the second‐order elastic constants of pentaerythritol (PE), and urea were performed using the output of the modeling program CRYSTAL98. CRYSTAL98 performs first principles calculations of periodic systems using Gaussian type basis functions.
openaire   +1 more source

CRYSTAL98 User's Manual,

1999
Manuale del programma di calcolo Crystal98 www.crystal.unito ...
VR Saunders   +6 more
openaire   +1 more source
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