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Gropen, O., Wahlgren, U., Pettersson, L. (1982) Effective core potential calculations on small molecules containing transition metal atoms. Chemical Physics, 66. 459-464 doi:10.1016/0301-0104(82)88047-6

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Reference TypeJournal (article/letter/editorial)
TitleEffective core potential calculations on small molecules containing transition metal atoms
JournalChemical Physics
AuthorsGropen, O.Author
Wahlgren, U.Author
Pettersson, L.Author
Year1982 (April)Volume66
PublisherElsevier BV
DOIdoi:10.1016/0301-0104(82)88047-6Search in ResearchGate
Generate Citation Formats
Mindat Ref. ID5949940Long-form Identifiermindat:1:5:5949940:0
GUID0
Full ReferenceGropen, O., Wahlgren, U., Pettersson, L. (1982) Effective core potential calculations on small molecules containing transition metal atoms. Chemical Physics, 66. 459-464 doi:10.1016/0301-0104(82)88047-6
Plain TextGropen, O., Wahlgren, U., Pettersson, L. (1982) Effective core potential calculations on small molecules containing transition metal atoms. Chemical Physics, 66. 459-464 doi:10.1016/0301-0104(82)88047-6
In(n.d.) Chemical Physics Vol. 66. Elsevier BV

See Also

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Gropen, O., Wahlgren, U., Pettersson, L. (1982) Effective core potential calculations on the NiH42− ion as a test case for studying rotational barriers. Chemical Physics, 66. 453-458 doi:10.1016/0301-0104(82)88046-4
Pettersson, Lars G.M., Wahlgren, Ulf, Gropen, Odd (1983) Effective core potential calculations using frozen orbitals. Applications to transition metals. Chemical Physics, 80. 7-16 doi:10.1016/0301-0104(83)85164-7
Pettersson, L., Wahlgren, U. (1982) An investigation of basis sets and basis set superposition error in transition metals using frozen core and frozen orbital techniques. Chemical Physics, 69. 185-192 doi:10.1016/0301-0104(82)88145-7
Pettersson, Lars G. M., Wahlgren, Ulf, Gropen, Odd (1987) Effective core potential parameters for first‐ and second‐row atoms. The Journal of Chemical Physics, 86 (4). 2176-2184 doi:10.1063/1.452115
Müller, J., Saethre, L.J., Gropen, O. (1983) Molecular structure and photoelectron spectra of H2S, H2Se, and H2Te. Effective core potential calculations on ground and valence ionic states. Chemical Physics, 75. 395-404 doi:10.1016/0301-0104(83)85206-9
Strömberg, Dan, Gropen, Odd, Wahlgren, Ulf (1989) Non-relativistic and relativistic calculations on some Zn, Cd and Hg complexes. Chemical Physics, 133. 207-219 doi:10.1016/0301-0104(89)80202-2
Higashi, M., Hiroike, E., Nakajima, T. (1982) Calculations of the Auger transition rates in molecules. I. Effect of the nonspherical potential: Application to CH4. Chemical Physics, 68. 377-382 doi:10.1016/0301-0104(82)87045-6
Wahlgren, Ulf (1978) Ab-initio and pseudo-potential calculations on some first, second and third row molecules. A comparative study. Chemical Physics, 32. 215-221 doi:10.1016/0301-0104(78)87053-0
(1982) List of Subjects. Chemical Physics, 66. 476pp. doi:10.1016/0301-0104(82)88050-6
Cundari, Thomas R., Stevens, Walter J., Sommerer, Shaun O. (1993) Effective core potential study of transition metal and lanthanide catalyzed hydrogen exchange. Chemical Physics, 178. 235-243 doi:10.1016/0301-0104(93)85064-f
Arbman, Mats, Holmberg, Sven, Lundholm, Martin, Siegbahn, Hans, Gropen, Odd, Wahlgren, Ulf (1983) Liquid ESCA measurements and ECP calculations on the 3d spectrum of I3−. Chemical Physics, 81. 113-119 doi:10.1016/0301-0104(83)85306-3
 
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