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Numerical calculation of energies of some excited states in a helium atom

✍ Scribed by B. Duan; X. -Y. Gu; Z. -Q. Ma


Book ID
111627145
Publisher
Springer
Year
2002
Tongue
English
Weight
359 KB
Volume
19
Category
Article
ISSN
1434-6060

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## Abstract The energies of the single‐configuration lowest Ο€ – Ο€\* singlet and triplet states of some conjugated hydrocarbons have been calculated by the MC‐SCF method using the conjugate‐gradient technique of minimisation. The results are compared with those calculated by other methods currently