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High-Precision Calculations of Vortex Sheet Motion

✍ Scribed by Jeffrey S. Ely; Gregory R. Baker

Publisher
Elsevier Science
Year
1994
Tongue
English
Weight
329 KB
Volume
111
Category
Article
ISSN
0021-9991

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## Abstract When using quantum chemistry techniques to calculate the energetics of bulk crystals, there is a need to calculate the Hartree‐Fock (HF) energy of the crystal at the basis‐set limit. We describe a strategy for achieving this, which exploits the fact that the HF energy of crystals can no