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Dissociation of cyclobutane, studied with HAM/3

✍ Scribed by L. Åsbrink; C. Fridh; E. Lindholm; G. Ahlgren

Publisher
Elsevier Science
Year
1978
Tongue
English
Weight
836 KB
Volume
33
Category
Article
ISSN
0301-0104

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## Abstract The electronic structure of tetracyanoquinodimethane (TCNQ) is calculated using the new semiempirical method HAM/3. The calculated photoelectron spectrum is in reasonable agreement with the measured spectrum. The excitation energies are obtained directly in HAM as the differences of the

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