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GAMESS-US: Schmidt MW, Baldridge KK, Boatz JA, Elbert ST, Gordon MS, Jensen JH, Koseki S, Matsunaga N, Nguyen KA, Su SJ, Windus TL, Dupuis M, Montgomery JA (1993) J Comput Chem 14: 1347
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(1993)
J Comput Chem
, vol.14
, pp. 1347
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Schmidt, M.W.1
Baldridge, K.K.2
Boatz, J.A.3
Elbert, S.T.4
Gordon, M.S.5
Jensen, J.H.6
Koseki, S.7
Matsunaga, N.8
Nguyen, K.A.9
Su, S.J.10
Windus, T.L.11
Dupuis, M.12
Montgomery, J.A.13
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85033887722
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DALTON 1.0: Helgaker T, Jensen HJA, Jørgensen P, Olsen J, Ruud K, Ågren H, Andersen T, Bak KL, Bakken V, Christiansen O, Dahle P, Dalskov EK, Enevoldsen T, Fernandez B, Heiberg H, Hettema H, Jonsson D, Kirpekar S, Kobayashi R, Koch H, Mikkelsen KV, Norman P, Packer MJ, Saue T, Taylor PR, Vahtras O (1997)
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(1997)
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Helgaker, T.1
Jensen, H.J.A.2
Jørgensen, 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..
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85033895028
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Gaussian, Inc., Pittsburgh Pa.
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Gaussian 94: Frisch MJ, Trucks GW, Schlegel HB, Gill PMW, Johnson BG, Robb MA, Cheeseman JR, Keith T, Petersson GA, Montgomery JA, Raghavachari K, Al-Laham MA, Zakrzewski VG, Ortiz JV, Foresman JB, Cioslowski, J, Stefanov BB, Nanayakkara A, Challacombe M, Peng CY, Ayala PY, Chen W, Wong MW, Andres JL, Replogle ES, Gomperts R, Martin RL, Fox DJ, Binkley JS, Defrees DJ, Baker J, Stewart JJP, Head-Gordon M, Gonzalez C, Pople JA (1995) Gaussian, Inc., Pittsburgh Pa.
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(1995)
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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.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
Cioslowski, J.16
Stefanov, B.B.17
Nanayakkara, A.18
Challacombe, M.19
Peng, C.Y.20
Ayala, P.Y.21
Chen, W.22
Wong, M.W.23
Andres, J.L.24
Replogle, E.S.25
Gomperts, R.26
Martin, R.L.27
Fox, D.J.28
Binkley, J.S.29
Defrees, D.J.30
Baker, J.31
Stewart, J.J.P.32
Head-Gordon, M.33
Gonzalez, C.34
Pople, J.A.35
more..
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All geometries can be obtained from the author by e-mail request: frj@dou.dk
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All geometries can be obtained from the author by e-mail request: frj@dou.dk
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