-
8
-
-
79951681614
-
-
J. Demaison, J.E. Boggs, A.G. Császár, CRC Press Boca Raton
-
W.D. Allen, and A.G. Császár J. Demaison, J.E. Boggs, A.G. Császár, Equilibrium Molecular Structures 2011 CRC Press Boca Raton 1 28
-
(2011)
Equilibrium Molecular Structures
, pp. 1-28
-
-
Allen, W.D.1
Császár, A.G.2
-
9
-
-
79951681614
-
-
J. Demaison, J.E. Boggs, A.G. Császár, CRC Press Boca Raton
-
J. Vázquez, and J.F. Stanton J. Demaison, J.E. Boggs, A.G. Császár, Equilibrium Molecular Structures 2011 CRC Press Boca Raton 53 87
-
(2011)
Equilibrium Molecular Structures
, pp. 53-87
-
-
Vázquez, J.1
Stanton, J.F.2
-
13
-
-
84877735657
-
-
MOLPRO is a package of ab initio programs written by H.-J. Werner, P.J. Knowles, F.R. Manby, M. Schütz, P. Celani, G. Knizia, T. Korona, R. Lindh, A. Mitrushenkov, G. Rauhut, T.B. Adler, R.D. Amos, A. Bernhardsson, A. Berning, D.L. Cooper, M.J.O. Deegan, A.J. Dobbyn, F. Eckert, E. Goll, C. Hampel, A. Hesselmann, G. Hetzer, T. Hrenar, G. Jansen, C. Köppl, Y. Liu, A.W. Lloyd, R.A. Mata, A.J. May, S.J. McNicholas, W. Meyer, M.E. Mura, A. Nicklaß, P. Palmieri, K. Pflüger, R. Pitzer, M. Reiher, T. Shiozaki, H. Stoll, A.J. Stone, R. Tarroni, T. Thorsteinsson.
-
-
-
Werner, H.-J.1
-
20
-
-
75749083809
-
-
Gaussian, Inc., Wallingford CT
-
M.J. Frisch, G.W. Trucks, H.B. Schlegel, G.E. Scuseria, M.A. Robb, J.R. Cheeseman, G. Scalmani, V. Barone, B. Mennucci, G.A. Petersson, H. Nakatsuji, M. Caricato, X. Li, H.P. Hratchian, A.F. Izmaylov, J. Bloino, G. Zheng, J.L. Sonnenberg, M. Hada, M. Ehara, K. Toyota, R. Fukuda, J. Hasegawa, M. Ishida, T. Nakajima, Y. Honda, O. Kitao, H. Nakai, T. Vreven, J.A. Montgomery, Jr., J.E. Peralta, F. Ogliaro, M. Bearpark, J.J. Heyd, E. Brothers, K.N. Kudin, V.N. Staroverov, R. Kobayashi, J. Normand, K. Raghavachari, A. Rendell, J.C. Burant, S.S. Iyengar, J. Tomasi, M. Cossi, N. Rega, J.M. Millam, M. Klene, J.E. Knox, J.B. Cross, V. Bakken, C. Adamo, J. Jaramillo, R. Gomperts, R.E. Stratmann, O. Yazyev, A.J. Austin, R. Cammi, C. Pomelli, J.W. Ochterski, R.L. Martin, K. Morokuma, V.G. Zakrzewski, G.A. Voth, P. Salvador, J.J. Dannenberg, S. Dapprich, A.D. Daniels, O. Farkas, J.B. Foresman, J.V. Ortiz, J. Cioslowski, and D.J. Fox, Gaussian 09, Revision A.02, Gaussian, Inc., Wallingford CT, 2009.
-
(2009)
Gaussian 09, Revision A.02
-
-
Frisch, M.J.1
Trucks, G.W.2
Schlegel, H.B.3
Scuseria, G.E.4
Robb, M.A.5
Cheeseman, J.R.6
Scalmani, G.7
Barone, V.8
Mennucci, B.9
Petersson, G.A.10
Nakatsuji, H.11
Caricato, M.12
Li, X.13
Hratchian, H.P.14
Izmaylov, A.F.15
Bloino, J.16
Zheng, G.17
Sonnenberg, J.L.18
Hada, M.19
Ehara, M.20
Toyota, K.21
Fukuda, R.22
Hasegawa, J.23
Ishida, M.24
Nakajima, T.25
Honda, Y.26
Kitao, O.27
Nakai, H.28
Vreven, T.29
Montgomery Jr., J.A.30
Peralta, J.E.31
Ogliaro, F.32
Bearpark, M.33
Heyd, J.J.34
Brothers, E.35
Kudin, K.N.36
Staroverov, V.N.37
Kobayashi, R.38
Normand, J.39
Raghavachari, K.40
Rendell, A.41
Burant, J.C.42
Iyengar, S.S.43
Tomasi, J.44
Cossi, M.45
Rega, N.46
Millam, J.M.47
Klene, M.48
Knox, J.E.49
Cross, J.B.50
Bakken, V.51
Adamo, C.52
Jaramillo, J.53
Gomperts, R.54
Stratmann, R.E.55
Yazyev, O.56
Austin, A.J.57
Cammi, R.58
Pomelli, C.59
Ochterski, J.W.60
Martin, R.L.61
Morokuma, K.62
Zakrzewski, V.G.63
Voth, G.A.64
Salvador, P.65
Dannenberg, J.J.66
Dapprich, S.67
Daniels, A.D.68
Farkas, O.69
Foresman, J.B.70
Ortiz, J.V.71
Cioslowski, J.72
Fox, D.J.73
more..
-
23
-
-
84910348697
-
-
University of Freiburg Germany
-
W. Geiger Diploma Thesis 1974 University of Freiburg Germany
-
(1974)
Diploma Thesis
-
-
Geiger, W.1
-
26
-
-
79951681614
-
-
J. Demaison, J.E. Boggs, A.G. Császár, CRC Press Boca Raton
-
J. Demaison J. Demaison, J.E. Boggs, A.G. Császár, Equilibrium Molecular Structures 2011 CRC Press Boca Raton 29 52
-
(2011)
Equilibrium Molecular Structures
, pp. 29-52
-
-
Demaison, J.1
-
30
-
-
79951681614
-
-
J. Demaison, J.E. Boggs, A.G. Császár, CRC Press Boca Raton (Appendix Va)
-
H.D. Rudolph, and J. Demaison J. Demaison, J.E. Boggs, A.G. Császár, Equilibrium Molecular Structures 2011 CRC Press Boca Raton 125 158 (Appendix Va)
-
(2011)
Equilibrium Molecular Structures
, pp. 125-158
-
-
Rudolph, H.D.1
Demaison, J.2
-
39
-
-
84877736134
-
-
doi: 10-121/jp311035c
-
N.C. Craig, Y. Chen, H.A. Fuson, H. Tian, H. van Besien, A.R. Conrad, M.J. Tubergen, H.D. Rudolph, J. Demaison, J. Phys. Chem. A doi: 10-121/jp311035c.
-
J. Phys. Chem. A
-
-
Craig, N.C.1
Chen, Y.2
Fuson, H.A.3
Tian, H.4
Van Besien, H.5
Conrad, A.R.6
Tubergen, M.J.7
Rudolph, H.D.8
Demaison, J.9
-
40
-
-
84866333084
-
-
J. Demaison, N.C. Craig, A.R. Conrad, M.J. Tubergen, and H.D. Rudolph J. Phys. Chem. A 116 2012 9116 9122
-
(2012)
J. Phys. Chem. A
, vol.116
, pp. 9116-9122
-
-
Demaison, J.1
Craig, N.C.2
Conrad, A.R.3
Tubergen, M.J.4
Rudolph, H.D.5
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