Collect. Czech. Chem. Commun.
1971, 36, 961-969
https://doi.org/10.1135/cccc19710961
Conjugated radicals. VIII. A comparison of the open shell SCF results obtained by the method of Longuet-Higgins and Pople and by the method of Roothaan
P. Čársky and R. Zahradník
Crossref Cited-by Linking
- Piech Krzysztof, Bally Thomas, Ichino Takatoshi, Stanton John: Vibronic spectra of the p-benzoquinone radical anion and cation: a matrix isolation and computational study. Phys. Chem. Chem. Phys. 2014, 16, 2011. <https://doi.org/10.1039/C3CP53960A>
- Hejda B., Málek J., Záliš S.: The CNDO-MO study of oxygen impurity states in AlN crystal. Czech J Phys 1977, 27, 1276. <https://doi.org/10.1007/BF01589022>
- Carsky Petr, Zahradnik Rudolf: Radicals: their molecular orbitals, properties, and reactivity. Acc. Chem. Res. 1976, 9, 407. <https://doi.org/10.1021/ar50107a004>
- Kuhn Jakob, Čársky Petr, Zahradnik Rudolf: SCF-CI MO treatment of radicals having degenerate ground states. Theoret. Chim. Acta 1974, 33, 263. <https://doi.org/10.1007/BF00551260>
- Čársky P., Zahradník R.: A remark on the comparison between the roothaan open shell and half-electron method. Theoret. Chim. Acta 1972, 26, 171. <https://doi.org/10.1007/BF00526545>
- Zahradník R., Čársky P.: Open shell cndo treatments on small and aliphatic radicals. Electronic spectra and some ground state properties. Theoret. Chim. Acta 1972, 27, 121. <https://doi.org/10.1007/BF00528155>