-
3
-
-
0012844796
-
-
Kirtley S.M., Mullins O.C., Chen J., van Elp J., George S.J., Chen C.T., O'Halloran T., Cramer S.P. Biochim. Biophys. Acta. 1132:1992;239.
-
(1992)
Biochim. Biophys. Acta
, vol.1132
, pp. 239
-
-
Kirtley, S.M.1
Mullins, O.C.2
Chen, J.3
Van Elp, J.4
George, S.J.5
Chen, C.T.6
O'Halloran, T.7
Cramer, S.P.8
-
6
-
-
0042584457
-
-
in press
-
Y. Li, O. Plashkevych, O. Vahtras, V. Carravetta, H. Ågren, J. Synchro. Rad. in press.
-
J. Synchro. Rad.
-
-
Li, Y.1
Plashkevych, O.2
Vahtras, O.3
Carravetta, V.4
Ågren, H.5
-
7
-
-
0042083447
-
-
submitted for publication
-
V. Carravetta, G. Contini, O. Plashkevych, H. Ågren, G. Polzonetti, submitted for publication.
-
-
-
Carravetta, V.1
Contini, G.2
Plashkevych, O.3
Ågren, H.4
Polzonetti, G.5
-
8
-
-
0042083444
-
-
submitted for publication
-
T. Evans, A.P. Woodhead, A. Gutierrez-Soza, G. Thornton, T.J. Hall, A.A. Davis, N.A. Young, P.B. Wells, R.J. Oldman, O. Plashkevych, O. Vahtras, H. Ågren, V. Carravetta, submitted for publication.
-
-
-
Evans, T.1
Woodhead, A.P.2
Gutierrez-Soza, A.3
Thornton, G.4
Hall, T.J.5
Davis, A.A.6
Young, N.A.7
Wells, P.B.8
Oldman, R.J.9
Plashkevych, O.10
Vahtras, O.11
Ågren, H.12
Carravetta, V.13
-
9
-
-
0043085248
-
-
submitted for publication
-
A. Snis, S. Matar, O. Plashkevych, L. Yang, H. Ågren, submitted for publication.
-
-
-
Snis, A.1
Matar, S.2
Plashkevych, O.3
Yang, L.4
Ågren, H.5
-
10
-
-
0000552341
-
-
G. Polzonetti, V. Carravetta, M.V. Russo, G. Contini, P. Parent, C. Laffon, J. Electron. Spectrosc. Rel. Phen. 98/99 (1999) 175.
-
(1999)
J. Electron. Spectrosc. Rel. Phen.
, vol.98-99
, pp. 175
-
-
Polzonetti, G.1
Carravetta, V.2
Russo, M.V.3
Contini, G.4
Parent, P.5
Laffon, C.6
-
12
-
-
0043085247
-
-
Private communication of unpublished results
-
Private communication of unpublished results.
-
-
-
-
18
-
-
0042045366
-
-
Refer to the internet address of for additional information
-
T. Helgaker, H.J. Aa Jensen, P. J φ rgensen, J. Olsen, K. Ruud, H. Ågren, T. Andersen, K.L. Bak, V. Bakken, O. Christiansen, P. Dahle, E.K. Dalskov, T. Enevoldsen, B. Fernandez, H. Heiberg, H. Hettema, D. Jonsson, S. Kirpekar, R. Kobayashi, H. Koch, K.V. Mikkelsen, P. Norman, M.J. Packer, T. Saue, P.R. Taylor, O. Vahtras, DALTON Version 1.01 (1997). Refer to the internet address of http://www.kjemi.uio.no/software/dalton/dalton.html for additional information.
-
(1997)
DALTON Version 1.01
-
-
Helgaker, T.1
Aa Jensen, H.J.2
Jorgensen, P.3
Olsen, J.4
Ruud, K.5
Ågren, H.6
Andersen, T.7
Bak, K.L.8
Bakken, V.9
Christiansen, O.10
Dahle, P.11
Dalskov, E.K.12
Enevoldsen, T.13
Fernandez, B.14
Heiberg, H.15
Hettema, H.16
Jonsson, D.17
Kirpekar, S.18
Kobayashi, R.19
Koch, H.20
Mikkelsen, K.V.21
Norman, P.22
Packer, M.J.23
Saue, T.24
Taylor, P.R.25
Vahtras, O.26
more..
-
19
-
-
0004133516
-
-
Gaussian, Inc., Pittsburgh, PA
-
M.J. Frisch, G.W. Trucks, H.B. Schlegel, P.M.W. Gill, B.G. Johnson, M.A. Robb, J.R. Cheeseman, T.A. Keith, G.A. Petersson, J.A. Montgomery, K. Raghavachari, M.A. Al-Laham, V.G. Zakrzewski, J.V. Ortiz, J.B. Foresman, C.Y. Peng, P.A. Ayala, M.W. Wong, J.L. Andres, E.S. Replogle, R. Gomperts, R.L. Martin, D.J. Fox, J.S. Binkley, D.J. Defrees, J. Baker, J.P. Stewart, M. Head-Gordon, C. Gonzalez, J.A. Pople, GAUSSIAN 94, Gaussian, Inc., Pittsburgh, PA, 1995.
-
(1995)
GAUSSIAN 94
-
-
Frisch, M.J.1
Trucks, G.W.2
Schlegel, H.B.3
Gill, P.M.W.4
Johnson, B.G.5
Robb, M.A.6
Cheeseman, J.R.7
Keith, T.A.8
Petersson, G.A.9
Montgomery, J.A.10
Raghavachari, K.11
Al-Laham, M.A.12
Zakrzewski, V.G.13
Ortiz, J.V.14
Foresman, J.B.15
Peng, C.Y.16
Ayala, P.A.17
Wong, M.W.18
Andres, J.L.19
Replogle, E.S.20
Gomperts, R.21
Martin, R.L.22
Fox, D.J.23
Binkley, J.S.24
Defrees, D.J.25
Baker, J.26
Stewart, J.P.27
Head-Gordon, M.28
Gonzalez, C.29
Pople, J.A.30
more..
-
20
-
-
0003422992
-
-
Gaussian Inc., Pittsburgh, PA
-
J.B. Foresman, A. Frisch, Exploring Chemistry with Electronic Structure Methods, 2nd edn., Gaussian Inc., Pittsburgh, PA, 1996.
-
(1996)
Exploring Chemistry with Electronic Structure Methods, 2nd Edn.
-
-
Foresman, J.B.1
Frisch, A.2
-
22
-
-
0042584445
-
-
as developed and distributed by the Molecular Science Computing Facility, Environmental and Molecular Sciences Laboratory which is part of the PNNL Pacific Northwest National Laboratory, PO Box 999, Richland, Washington 99352, USA, and funded by the US Department of Energy. The Pacific Northwest National Laboratory is a multi-program laboratory operated by Battelle Memorial Institute for the US Department of Energy under contract DE-AC06-76RLO 1830. Please, contact Drs. D. Feller, K. Schuchardt, or D. Jones for further information
-
Data for valence basis functions were down-loaded from the Extensible Computational Chemistry Environment Basis Set Database, Version 1.0 (http://www.emsl.pnl.gov:2080/forms/basisform.html), as developed and distributed by the Molecular Science Computing Facility, Environmental and Molecular Sciences Laboratory which is part of the PNNL Pacific Northwest National Laboratory, PO Box 999, Richland, Washington 99352, USA, and funded by the US Department of Energy. The Pacific Northwest National Laboratory is a multi-program laboratory operated by Battelle Memorial Institute for the US Department of Energy under contract DE-AC06-76RLO 1830. Please, contact Drs. D. Feller, K. Schuchardt, or D. Jones for further information.
-
Data for Valence Basis Functions Were Down-loaded from the Extensible Computational Chemistry Environment Basis Set Database, Version 1.0
-
-
-
23
-
-
0003914786
-
-
in: T.N. Rescigno, B.V. McKoy, B. Schneider (Eds.), Plenum, New York
-
P.W. Langhoff, in: T.N. Rescigno, B.V. McKoy, B. Schneider (Eds.), Electron Molecule and Photon Molecule Collisions, Plenum, New York, 1979.
-
(1979)
Electron Molecule and Photon Molecule Collisions
-
-
Langhoff, P.W.1
|