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Author:Grein, F.

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Tseng, T.J.; Grein, F., Low-lying valence states of the PO molecule according to configuration-interaction calculations, J. Chem. Phys., 1973, 59, 6563. [all data]

Bialski, M.; Grein, F., Theoretical studies on low-lying valence states of NS, SiF, and CCl, J. Mol. Spectrosc., 1976, 61, 321. [all data]

Banerjee, A.; Grein, F., Multiconfiguration wavefunctions for excited states. Selection of optimal configurations: the b1Σ+ and d1Σ+ states of NH, J. Chem. Phys., 1977, 66, 1054-1062. [all data]

Banerjee, A.; Grein, F., Rotation-vibration analysis by finite difference perturbation technique. Application to 1Σ+ states of NH, J. Chem. Phys., 1977, 66, 2589-2597. [all data]

Grein, F.; Kapur, A., Low-lying valence and Rydberg states of nitric oxide NO. Configuration interaction studies, J. Chem. Phys., 1982, 77, 415-423. [all data]

Grein, F.; Kapur, A., The electronic spectrum of PN. A configuration interaction study, J. Mol. Spectrosc., 1983, 99, 25-34. [all data]

Grein, F.; Kapur, A., Configuration interaction studies on low-lying valence and Rydberg states of PO, J. Chem. Phys., 1983, 78, 339-346. [all data]

Lefebvre-Brion, H.; Grein, F., Comment on "Configuration interaction studies on low-lying valence and Rydberg states of PO", J. Chem. Phys., 1983, 79, 1102. [all data]

Grein, F.; Peyerimhoff, S.D.; Buenker, R.J., Theoretical studies on excited states of Ne2. I. MRD-Cl potential energy curves, J. Chem. Phys., 1985, 82, 353-363. [all data]

Karna, S.P.; Grein, F., Ground and low-lying valence states of BN: a CI study, Chem. Phys., 1985, 98, 207-219. [all data]

Karna, S.P.; Grein, F., Ground and low-lying excited states of BN+ and BN- obtained by configuration-interaction methods, Mol. Phys., 1985, 56, 641-652. [all data]

Karna, S.P.; Grein, F., Low-lying valence and Rydberg states of NS, obtained by configuration-interaction studies, J. Mol. Spectrosc., 1986, 120, 284-291. [all data]

Karna, S.P.; Grein, F., Electronic states of NS+. A configuration-interaction study, Chem. Phys., 1986, 109, 35-38. [all data]

Karna, S.P.; Grein, F., Semidiffuse states of diatomic molecules: configuration interaction studies of the lowest 2Σ+ and 2Δ states of NS, SiF, and CCl, Int. J. Quantum Chem., 1986, 29, 755-766. [all data]

Bruna, P.J.; Grein, F., The low-lying electronic state X3Σ-, a1Δ and b1Σ+ of PO-, NS- and PS- according to MRD-CI calculations, J. Phys. B:, 1987, 20, 5967-5986. [all data]

Grein, F.; Peyerimhoff, S.D., Theoretical studies on excited states of Ne2. II. Potential curves for states dissociating to Ne + Ne* (3s) with semiempirical spin-orbit interaction, and comparison with spectroscopic results, J. Chem. Phys., 1987, 87, 4684-4692. [all data]

Karna, S.P.; Grein, F., Configuration-interaction study of low-lying valence states of BO+, Mol. Phys., 1987, 61, 1055-1062. [all data]

Karna, S.P.; Grein, F., Electronic states of SiF and SiF+: configuration-interaction studies, J. Mol. Spectrosc., 1987, 122, 28-40. [all data]

Karna, S.P.; Grein, F., BO: low-lying electronic states obtained by configuration-interaction studies, J. Mol. Spectrosc., 1987, 122, 356-364. [all data]

Karna, S.P.; Bruna, P.J.; Grein, F., Configuration interaction studies on the electronic states and structure of PS, J. Phys. B:, 1988, 21, 1303-1313. [all data]

Bruna, P.J.; Grein, F., Ab initio study of the electronic structure of AlP- and electron affinity of AlP, J. Phys. B:, 1989, 22, 1913-1929. [all data]

Meier, U.; Peyerimhoff, S.D.; Bruna, P.J.; Grein, F., The GaAs and GaAs+ radicals. An ab initio MRD-Cl study, J. Mol. Spectrosc., 1989, 134, 259-280. [all data]

Anglada, J.; Bruna, P.J.; Grein, F., Theoretical study of low-lying electronic states of CoH+, J. Chem. Phys., 1990, 92, 6732-6741. [all data]

Karna, S.P.; Grein, F.; Engels, B.; Peyerimhoff, S.D., Ab initio configuration-interaction studies of the ground state potential energy and hyperfine coupling constants of 35Cl2-, Mol. Phys., 1990, 69, 549-557. [all data]

Vasudevan, K.; Grein, F., J. Chem. Phys., 1978, 68, 1418. [all data]