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On the Wigner transforms of some simple systems and their semiclassical interpretation

✍ Scribed by Casas, M; Krivine, H; Martorell, J

Book ID
115539404
Publisher
Institute of Physics
Year
1991
Tongue
English
Weight
419 KB
Volume
12
Category
Article
ISSN
0143-0807

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+ Fwere used as simple test cases to assess the additivity of basis set effects on reaction energetics computed at the MP4 level. The 6- 31G and 6-311G basis sets were augmented with 1, 2, and 3 sets of polarization functions, higher angular momentum polarization functions, and diffuse functions (27