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Author:Ahlrichs

15 matching references were found.

Binnewies, M.; Solouki, B.; Bock, H.; Becherer, R.; Ahlrichs, R., O=P-Cl und S=P-Cl: Ionisation in der Gasphase, Angew. Chem., 1984, 96, 704. [all data]

Ahlrichs, R.; Becherer, R.; Binnewies, M.; Borrmann, H.; Schunck, S.; Schnockel, H., Formation and structure of molecular O:P-F. Mass spectrometry, infrared spectra of the matrix isolated species and ab initio calculations, J. Am. Chem. Soc., 1986, 108, 25, 7905, https://doi.org/10.1021/ja00285a004 . [all data]

Ahlrichs, R.; Bar, M.; Plitt, H.S.; Schnockel, H., The stability of PN and (PN)3. Ab initio calculations and matrix infrared investigations, Chem. Phys. Lett., 1989, 161, 2, 179, https://doi.org/10.1016/0009-2614(89)85053-5 . [all data]

Ahlrichs, R.; Ehrhard, C.; Lakenbrink, M.; Schunck, S.; Schnockel, H., Molecular PO2Cl: matrix IR investigations and ab initio SCF calculations, J. Am. Chem. Soc., 1986, 108, 13, 3596, https://doi.org/10.1021/ja00273a008 . [all data]

Ahlrichs, R.; Schunck, S.; Schnockel, H., Zur Struktur von molekularem PNO, Matrixisolation und ab-initio-Rechnungen, Angew. Chem., 1988, 100, 3, 418, https://doi.org/10.1002/ange.19881000321 . [all data]

Becherer, R.; Ahlrichs, R., The impact of higher polarization basis sets on molecular ab initio results. III. The ground state of Cl2 in comparison with other diatomics, Chem. Phys., 1985, 99, 389-395. [all data]

Bohm, H.-J.; Ahlrichs, R., The N2-N2 interaction. A theoretical investigation, Mol. Phys., 1985, 55, 1159-1169. [all data]

Jankowski, K.; Becherer, R.; Scharf, P.; Schiffer, H.; Ahlrichs, R., The impact of higher polarization basis functions on molecular ab initio results. I. The ground state of F2, J. Chem. Phys., 1985, 82, 1413-1419. [all data]

Scharf, P.; Brode, S.; Ahlrichs, R., Electronic structure and bonding in the ground state of Cu2, Chem. Phys. Lett., 1985, 113, 447-450. [all data]

Langhoff, S.R.; Bauschlicher, C.W., Jr.; Partridge, H.; Ahlrichs, R., Theoretical study of the dipole moments of selected alkaline-earth halides, J. Chem. Phys., 1986, 84, 5025-5031. [all data]

Ahlrichs, R.; Jankowski, K.; Wasilewski, J., Accurate MR CI studies of the N2 ground state, Chem. Phys., 1987, 111, 263-269. [all data]

Ahlrichs, R.; Bohm, H.J.; Brode, S.; Tang, K.T.; Toennies, J.P., Interaction potentials for alkali ion-rare gas and halogen ion-rare gas systems, J. Chem. Phys., 1988, 88, 6290-6302. [all data]

Bar, M.; Ahlrichs, R., Theoretical investigation of the AlCu ground state, Acta Phys. Pol., 1991, 178, 241-245. [all data]

Brode, S.; Koelmel, C.; Schiff, H.; Ahlrichs, R., Octupole moments of methane, tetrafluoromethane, tetrachloromethane, and silane. A theoretical investigation, Z. Phys. Chem. (Munich), 1987, 155, 23. [all data]

Sagarik, K.P.; Ahlrichs, R.; Brode, S., Intermolecular potentials for ammonia based on the test particle model and the coupled pair functional method, Mol. Phys., 1986, 57, 1247. [all data]