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Correlated electron density of N2

✍ Scribed by Günther Lauer; Hermann Meyer; Karl-Wilhelm Schulte; Armin Schweig; Hans-Lothar Hase

Publisher
Elsevier Science
Year
1979
Tongue
English
Weight
308 KB
Volume
67
Category
Article
ISSN
0009-2614

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✦ Synopsis

The electron density difference between the correlated density of N2 and the superimposed AHF atom densities is calculated using the PERTCI program system and various AHF GTO wavefunctions. The result is compared with the corresponding experimental density recently derived from electron diffraction measurements in the gas phase.

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