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Study of ground state and some low-lying excited states of formaldehyde molecule by CNDO/VN−1method

✍ Scribed by E. I. Cheglokov; A. F. Terpugova; B. F. Samsonov; V. A. Kilin

Book ID
112440722
Publisher
Springer
Year
1978
Tongue
English
Weight
363 KB
Volume
21
Category
Article
ISSN
1573-9228

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Basis dependence of wave functions of th
Basis dependence of wave functions of the ground state and low-lying excited states of planar formaldehyde
✍ Kiyoshi Tanaka 📂 Article 📅 1974 🏛 John Wiley and Sons 🌐 English ⚖ 530 KB

## Abstract By the use of three bases containing 3__p__ STO's possessing different diffuseness, the electronic structure of several excited states (valence‐ and Rydberg‐type) of planar formaldehyde is investigated by limited CI calculations. The spatial extension of the valence‐type state is indepe