๐”– Bobbio Scriptorium
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Just how ab initio is ab initio quantum chemistry?

โœ Scribed by Eric R. Scerri


Book ID
111582374
Publisher
Springer
Year
2004
Tongue
English
Weight
120 KB
Volume
6
Category
Article
ISSN
1386-4238

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๐Ÿ“œ SIMILAR VOLUMES


Charge-conserving integral approximation
โœ Douglas L. Wilhite; Robert N. Euwema ๐Ÿ“‚ Article ๐Ÿ“… 1973 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 326 KB

Two charge-conserving integral approximations are presented, one for nqlecting and another for approximating the less important integrals that arise in quantum chemicsl calculations on molecular systems. Results are presented for test calculations on ethylene and glycine.

How reliable are ab initio calculations?
โœ Hans-Georg Mack; Heinz Oberhammer ๐Ÿ“‚ Article ๐Ÿ“… 1992 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 121 KB
AB INITIO DYNAMICS OF SURFACE CHEMISTRY
โœ Radeke, Michelle R.; Carter, Emily A. ๐Ÿ“‚ Article ๐Ÿ“… 1997 ๐Ÿ› Annual Reviews ๐ŸŒ English โš– 234 KB