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Author:Walch, S.P.

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17 matching references were found.

Aquino, A.J.A.; Taylor, P.R.; Walch, S.P., Structure, properties, and photodissociation of O-4(-), J. Chem. Phys., 2001, 114, 7, 3010-3017, https://doi.org/10.1063/1.1288379 . [all data]

Aquino, A.J.A.; Taylor, P.R.; Walch, S.P., Structure, properties, and photodissociation of O[sub 4][sup -], J. Chem. Phys., 2001, 114, 7, 3010, https://doi.org/10.1063/1.1288379 . [all data]

Walch, S.P.; Goddard, W.A., III, Dipole moments and electric field gradients for correlated wavefunctions of NO: the X2«PI», A2«SIGMA»+, and D2«SIGMA»+ states, Chem. Phys. Lett., 1975, 33, 18. [all data]

Bauschlicher, C.W., Jr.; Walch, S.P., On the d bond in ScH, J. Chem. Phys., 1982, 76, 4560-4563. [all data]

Bauschlicher, C.W., Jr.; Walch, S.P.; Siegbahn, P.E.M., On the nature of the bonding in Cu2, J. Chem. Phys., 1982, 76, 6015-6017. [all data]

Walch, S.P.; Bauschlicher, C.W., Jr.; Siegbahn, P.E.M.; Partridge, H., All-electron GVB/CI potential curves for the X1«SIGMA»g+ state of Cs2, Chem. Phys. Lett., 1982, 92, 54-58. [all data]

Walch, S.P.; Bauschlicher, C.W., Jr., On incorporation of atomic correlation in transition-metal molecular calculations: NiH, Chem. Phys. Lett., 1982, 86, 66-70. [all data]

Bauschlicher, C.W., Jr.; Walch, S.P.; Siegbahn, P.E.M., On the nature of the bonding in Cu2 - an ab initio viewpoint, J. Chem. Phys., 1983, 78, 3347-3348. [all data]

Laskowski, B.C.; Walch, S.P.; Christiansen, P.A., Ab initio calculation of the X1«SIGMA»+ state of CsH, J. Chem. Phys., 1983, 78, 6824-6832. [all data]

Partridge, H.; Dixon, D.A.; Walch, S.P.; Bauschlicher, C.W., Jr.; Gole, J.L., Electron affinities of the alkali dimers: Na2, K2, and Rb2, J. Chem. Phys., 1983, 79, 1859-1865. [all data]

Walch, S.P.; Bauschlicher, C.W., Jr.; Roos, B.O.; Nelin, C.J., Theoretical evidence for multiple 3d bonding in the V2 and Cr2 molecules, Chem. Phys. Lett., 1983, 103, 175-179. [all data]

Walch, S.P.; Bauschlicher, C.W., Jr., CAS SCF CI calculations for the 3«SIGMA»g-, 1«SIGMA»g+, 3«SIGMA»u+, and 5«DELTA»u states of Se2, Chem. Phys. Lett., 1983, 94, 290-295. [all data]

Walch, S.P.; Bauschlicher, C.W., Jr., Theoretical evidence for multiple one-electron 3d bonding in a first row transition metal dimer: the 5«SIGMA»u- state of Sc2, J. Chem. Phys., 1983, 79, 3590-3591. [all data]

Walch, S.P.; Bauschlicher, C.W., Jr., CASSCF/Cl calculations for first row transition metal hydrides: the TiH(4«PHI»), VH(5«DELTA»), CrH(6«SIGMA»+), MnH(7«SIGMA»+), FeH(4,6«DELTA»), and NiH(2«DELTA») states, J. Chem. Phys., 1983, 78, 4597-4605. [all data]

Walch, S.P., Theoretical evidence supporting the 4«DELTA» ground-state assignment for FeH, Chem. Phys. Lett., 1984, 105, 54-57. [all data]

Walch, S.P.; Bauschlicher, C.W., Jr.; Langhoff, S.R., Calculated electric dipole moment of NiH X2«DELTA», J. Chem. Phys., 1985, 83, 5351-5352. [all data]

Bauschlicher, C.W., Jr.; Partridge, H.; Langhoff, S.R.; Taylor, P.R.; Walch, S.P., Accurate ab initio calculations which demonstrate a 3«PI»u ground state for Al2, J. Chem. Phys., 1987, 86, 7007-7012. [all data]