-
2
-
-
21044441392
-
-
Charton, M. Charton, B. I. Eds., JAI Press, Inc.: Stamford Connecticut
-
Seybold, P. G., In Advances in Quantitative Structure-Property Relationships;, Charton, M., Charton, B. I., Eds., 2002; Vol. 3, JAI Press, Inc.: Stamford Connecticut, pp 109-136.
-
(2002)
Advances in Quantitative Structure-Property Relationships
, vol.3
, pp. 109-136
-
-
Seybold, P.G.1
-
7
-
-
0002313779
-
-
Politzer, P.,;, Huheey, J. E.,;, Murray, J. S.,;, Grodzicki, M., J Mol Struct (THEOCHEM) 1992, 259, 99.
-
(1992)
J Mol Struct (THEOCHEM)
, vol.259
, pp. 99
-
-
Politzer, P.1
Huheey, J.E.2
Murray, J.S.3
Grodzicki, M.4
-
8
-
-
0242295578
-
-
Politzer, P.,;, Murray, J. S.,;, Grice, M. E., Struct Bonding 1993, 80, 101.
-
(1993)
Struct Bonding
, vol.80
, pp. 101
-
-
Politzer, P.1
Murray, J.S.2
Grice, M.E.3
-
9
-
-
84888246185
-
-
Chapter 3 Lipkowitz, K. B. Boyd, D. B. Eds.; VCH: New York
-
Bachrach, S. M., In Reviews in Computational Chemistry;, Lipkowitz, K. B., Boyd, D. B., Eds.; VCH: New York, 1994; Vol. 5, Chapter 3, pp 171-227.
-
(1994)
Reviews in Computational Chemistry
, vol.5
, pp. 171-227
-
-
Bachrach, S.M.1
-
10
-
-
0037026962
-
-
Gross, K. C.,;, Seybold, P. G.,;, Hadad, C. M., Int J Quantum Chem 2002, 90, 445.
-
(2002)
Int J Quantum Chem
, vol.90
, pp. 445
-
-
Gross, K.C.1
Seybold, P.G.2
Hadad, C.M.3
-
11
-
-
36148995600
-
-
Reed, A. E.,;, Weinstock, R. B.,;, Weinhold, F., J Chem Phys 1985, 83, 735.
-
(1985)
J Chem Phys
, vol.83
, pp. 735
-
-
Reed, A.E.1
Weinstock, R.B.2
Weinhold, F.3
-
13
-
-
0034323922
-
-
Gross, K. C.,;, Seybold, P. G., Int J Quantum Chem 2000, 80, 1107.
-
(2000)
Int J Quantum Chem
, vol.80
, pp. 1107
-
-
Gross, K.C.1
Seybold, P.G.2
-
14
-
-
0035890870
-
-
Gross, K. C.,;, Seybold, P. G., Int J Quantum Chem 2001, 85, 569.
-
(2001)
Int J Quantum Chem
, vol.85
, pp. 569
-
-
Gross, K.C.1
Seybold, P.G.2
-
15
-
-
41549096107
-
-
Hollingsworth, C.,;, Seybold, P. G.,;, Hadad, C. M., Int J Quantum Chem 2002, 90, 1396.
-
(2002)
Int J Quantum Chem
, vol.90
, pp. 1396
-
-
Hollingsworth, C.1
Seybold, P.G.2
Hadad, C.M.3
-
16
-
-
73049111151
-
-
Kreye, W. C.,;, Seybold, P. G., Int J Quantum Chem 2009, 109, 3679.
-
(2009)
Int J Quantum Chem
, vol.109
, pp. 3679
-
-
Kreye, W.C.1
Seybold, P.G.2
-
17
-
-
49149147973
-
-
Gasteiger, J.,;, Marsili, M., Tetrahedron 1980, 36, 3219.
-
(1980)
Tetrahedron
, vol.36
, pp. 3219
-
-
Gasteiger, J.1
Marsili, M.2
-
18
-
-
0000939786
-
-
Marsili, M.,;, Gasteiger, J., Croat Chem Acta 1980, 53, 601.
-
(1980)
Croat Chem Acta
, vol.53
, pp. 601
-
-
Marsili, M.1
Gasteiger, J.2
-
19
-
-
33845378399
-
-
Mortier, W. J.,;, Van Genechten, K.,;, Gasteiger, J., J Am Chem Soc 1985, 107, 829.
-
(1985)
J Am Chem Soc
, vol.107
, pp. 829
-
-
Mortier, W.J.1
Van Genechten, K.2
Gasteiger, J.3
-
21
-
-
33846687108
-
-
Politzer, P.,;, Lane, P.,;, Concha, M. C.,;, Ma, Y.,;, Murray, J. S., J Mol Model 2007, 13, 305.
-
(2007)
J Mol Model
, vol.13
, pp. 305
-
-
Politzer, P.1
Lane, P.2
Concha, M.C.3
Ma, Y.4
Murray, J.S.5
-
22
-
-
0000540864
-
-
Wiberg, K. B.,;, Hadad, C. M.,;, Breneman, C. M.,;, Laidig, K. E.,;, Murco, M. A.,;, LePage, T. J., Science 1991, 252, 1266.
-
(1991)
Science
, vol.252
, pp. 1266
-
-
Wiberg, K.B.1
Hadad, C.M.2
Breneman, C.M.3
Laidig, K.E.4
Murco, M.A.5
Lepage, T.J.6
-
23
-
-
47249165244
-
-
Politzer, P.,;, Murray, J. S.,;, Concha, M. C., J Mol Model 2008, 14, 659.
-
(2008)
J Mol Model
, vol.14
, pp. 659
-
-
Politzer, P.1
Murray, J.S.2
Concha, M.C.3
-
24
-
-
33846676142
-
-
Clark, T.,;, Hennemann, M.,;, Murray, J. S.,;, Politzer, P., J Mol Model 2007, 13, 291.
-
(2007)
J Mol Model
, vol.13
, pp. 291
-
-
Clark, T.1
Hennemann, M.2
Murray, J.S.3
Politzer, P.4
-
25
-
-
35348945340
-
-
Politzer, P.,;, Murray, J. S.,;, Lane, P., Int J Quantum Chem 2007, 107, 3046.
-
(2007)
Int J Quantum Chem
, vol.107
, pp. 3046
-
-
Politzer, P.1
Murray, J.S.2
Lane, P.3
-
26
-
-
67849106149
-
-
Göbel, M.,;, Tchitchanov, B. H.,;, Murray, J. S.,;, Politzer, P.,;, Klapötke, T. M., Nat Chem 2009, 1, 229.
-
(2009)
Nat Chem
, vol.1
, pp. 229
-
-
Göbel, M.1
Tchitchanov, B.H.2
Murray, J.S.3
Politzer, P.4
Klapötke, T.M.5
-
27
-
-
37049137764
-
-
Sadova, N. I.,;, Popik, N. I.,;, Vilkov, L. V.,;, Pankrushev, J. A.,;, Shlyapochnikov, V. A., J Chem Soc Chem Commun 1973, 708.
-
(1973)
J Chem Soc Chem Commun
, pp. 708
-
-
Sadova, N.I.1
Popik, N.I.2
Vilkov, L.V.3
Pankrushev, J.A.4
Shlyapochnikov, V.A.5
-
28
-
-
0004133516
-
-
Gaussian, Inc.: Pittsburgh, PA
-
Frisch, M. J.,;, Trucks, G. W.,;, Schlegel, H. B.,;, Scuseria, G. E.,;, Robb, M. A.,;, Cheeseman, J. R.,;, Zakrzewski, V. G.,;, Montgomery, J. A., Jr.,;, Stratmann, R. E.,;, Burant, J. C.,;, Dapprich, S.,;, Millam, J. M.,;, Daniels, A. D.,;, Kudin, K. N.,;, Strain, M. C.,;, Farkas, O.,;, Tomasi, J.,;, Barone, V.,;, Cossi, M.,;, Cammi, R.,;, Mennucci, B.,;, Pomelli, C.,;, Adamo, C.,;, Clifford, S.,;, Ochterski, J.,;, Petersson, G. A.,;, Ayala, P. Y.,;, Cui, Q.,;, Morokuma, K.,;, Malick, D. K.,;, Rabuck, A. D.,;, Raghavachari, K.,;, Foresman, J. B.,;, Cioslowski, J.,;, Ortiz, J. V.,;, Baboul, A. G.,;, Stefanov, B. B.,;, Liu, G.,;, Liashenko, A.,;, Piskorz, P.,;, Komaromi, I.,;, Gomperts, R.,;, Martin, R. L.,;, Fox, D. J.,;, Keith, T.,;, Al-Laham, M. A.,;, Peng, C. Y.,;, Nanayakkara, A.,;, Challacombe, M.,;, Gill, P. M. W.,;, Johnson, B.,;, Chen, W.,;, Wong, M. W.,;, Andres, J. L.,;, Gonzalez, C.,;, Head-Gordon, M.,;, Replogle, E. S.,;, Pople, J. A., Gaussian98, Revision A.9; Gaussian, Inc.: Pittsburgh, PA, 1998.
-
(1998)
Gaussian98, Revision A.9
-
-
Frisch, M.J.1
Trucks, G.W.2
Schlegel, H.B.3
Scuseria, G.E.4
Robb, M.A.5
Cheeseman, J.R.6
Zakrzewski, V.G.7
Montgomery, Jr.J.A.8
Stratmann, R.E.9
Burant, J.C.10
Dapprich, S.11
Millam, J.M.12
Daniels, A.D.13
Kudin, K.N.14
Strain, M.C.15
Farkas, O.16
Tomasi, J.17
Barone, V.18
Cossi, M.19
Cammi, R.20
Mennucci, B.21
Pomelli, C.22
Adamo, C.23
Clifford, S.24
Ochterski, J.25
Petersson, G.A.26
Ayala, P.Y.27
Cui, Q.28
Morokuma, K.29
Malick, D.K.30
Rabuck, A.D.31
Raghavachari, K.32
Foresman, J.B.33
Cioslowski, J.34
Ortiz, J.V.35
Baboul, A.G.36
Stefanov, B.B.37
Liu, G.38
Liashenko, A.39
Piskorz, P.40
Komaromi, I.41
Gomperts, R.42
Martin, R.L.43
Fox, D.J.44
Keith, T.45
Al-Laham, M.A.46
Peng, C.Y.47
Nanayakkara, A.48
Challacombe, M.49
Gill, P.M.W.50
Johnson, B.51
Chen, W.52
Wong, M.W.53
Andres, J.L.54
Gonzalez, C.55
Head-Gordon, M.56
Replogle, E.S.57
Pople, J.A.58
more..
-
30
-
-
70749106331
-
-
Yale University: New Haven, CT
-
Keith, T., AIMALL; Yale University: New Haven, CT. 2010.
-
(2010)
AIMALL
-
-
Keith, T.1
-
31
-
-
80855149961
-
-
See the PETRA description at. Accessed on September 2001
-
See the PETRA description at. Accessed on September 2001.
-
-
-
|