-
4
-
-
33845551816
-
-
(Cu, Ag, Au)
-
Chenier, J. H. B.; Howard, J. A.; Mile, B.; Sutcliffe, R. J. Am. Chem. Soc. 1983, 105, 788 (Cu, Ag, Au)
-
(1983)
J. Am. Chem. Soc.
, vol.105
, pp. 788
-
-
Chenier, J.H.B.1
Howard, J.A.2
Mile, B.3
Sutcliffe, R.4
-
7
-
-
0000480794
-
-
(Al)
-
Chertihin, G. V.; Andrews, L.; Taylor, P. R. J. Am. Chem. Soc. 1994, 116, 3515 (Al)
-
(1994)
J. Am. Chem. Soc.
, vol.116
, pp. 3515
-
-
Chertihin, G.V.1
Andrews, L.2
Taylor, P.R.3
-
9
-
-
0001758223
-
-
(Li, Na, K)
-
Kasai, P. H. J. Am. Chem. Soc. 1992, 114, 3299 (Li, Na, K)
-
(1992)
J. Am. Chem. Soc.
, vol.114
, pp. 3299
-
-
Kasai, P.H.1
-
10
-
-
33845556659
-
-
(Ni, Cu)
-
Ozin, G. A.; McIntosh, D. F.; Power, W. J.; Messmer, R. P. Inorg. Chem. 1981, 20, 1782 (Ni, Cu)
-
(1981)
Inorg. Chem.
, vol.20
, pp. 1782
-
-
Ozin, G.A.1
McIntosh, D.F.2
Power, W.J.3
Messmer, R.P.4
-
11
-
-
0000368980
-
-
(Ni)
-
Kline, E. S.; Kafafi, Z. H.; Hauge, R. H.; Margrave, J. L. J. Am. Chem. Soc. 1987, 109, 2402 (Ni)
-
(1987)
J. Am. Chem. Soc.
, vol.109
, pp. 2402
-
-
Kline, E.S.1
Kafafi, Z.H.2
Hauge, R.H.3
Margrave, J.L.4
-
12
-
-
77956168062
-
-
(Sc, Y)
-
Teng, Y.-L.; Xu, Q. J. Phys. Chem. A 2010, 114, 9069 (Sc, Y)
-
(2010)
J. Phys. Chem. A
, vol.114
, pp. 9069
-
-
Teng, Y.-L.1
Xu, Q.2
-
13
-
-
50349083132
-
-
(Ti, Zr, Hf)
-
Cho, H.-G.; Kushto, P.; Andrews, L.; Bauschlicher, C. W., Jr. J. Phys. Chem. A 2008, 112, 6295 (Ti, Zr, Hf)
-
(2008)
J. Phys. Chem. A
, vol.112
, pp. 6295
-
-
Cho, H.-G.1
Kushto, P.2
Andrews, L.3
Bauschlicher Jr., C.W.4
-
14
-
-
77956728280
-
-
(V, Nb, Ta)
-
Cho, H.-G.; Andrews, L. J. Phys. Chem. A 2010, 114, 10028 (V, Nb, Ta)
-
(2010)
J. Phys. Chem. A
, vol.114
, pp. 10028
-
-
Cho, H.-G.1
Andrews, L.2
-
16
-
-
0037461644
-
-
(Ni, Pd)
-
Wang, X.; Andrews, L. J. Phys. Chem. A 2003, 107, 337 (Ni, Pd)
-
(2003)
J. Phys. Chem. A
, vol.107
, pp. 337
-
-
Wang, X.1
Andrews, L.2
-
19
-
-
0001545924
-
-
(common bands) See also J. Phys. Chem. Ref. Data 1994, Monograph 3
-
Andrews, L.; Kushto, G. P.; Zhou, M. F.; Willson, S. P.; Souter, P. F. J. Chem. Phys. 1999, 110, 4457 (common bands) See also Jacox, M. E. J. Phys. Chem. Ref. Data 1994, Monograph 3
-
(1999)
J. Chem. Phys.
, vol.110
, pp. 4457
-
-
Andrews, L.1
Kushto, G.P.2
Zhou, M.F.3
Willson, S.P.4
Souter, P.F.5
Jacox, M.E.6
-
20
-
-
79956146022
-
-
2.
-
Andrews, L.; Kushto, G. P.; Zhou, M. F.; Willson, S. P.; Souter, P. F. J. Chem. Phys. 1998, 27, 2 115.
-
(1998)
J. Chem. Phys.
, vol.27
, pp. 115
-
-
Andrews, L.1
Kushto, G.P.2
Zhou, M.F.3
Willson, S.P.4
Souter, P.F.5
Jacox, M.E.6
-
21
-
-
79956102275
-
-
1.
-
Andrews, L.; Kushto, G. P.; Zhou, M. F.; Willson, S. P.; Souter, P. F. J. Chem. Phys. 2003, 32, 1 1.
-
(2003)
J. Chem. Phys.
, vol.32
, pp. 1
-
-
Andrews, L.1
Kushto, G.P.2
Zhou, M.F.3
Willson, S.P.4
Souter, P.F.5
Jacox, M.E.6
-
22
-
-
0029963385
-
-
(Be, Mg)
-
Thompson, C. A.; Andrews, L. J. Am. Chem. Soc. 1996, 118, 10242 (Be, Mg)
-
(1996)
J. Am. Chem. Soc.
, vol.118
, pp. 10242
-
-
Thompson, C.A.1
Andrews, L.2
-
23
-
-
0000287878
-
-
Andrews, L.; Hassanzadeh, P.; Martin, J. M. L.; Taylor, P. R. J. Phys. Chem. 1993, 97, 5839
-
(1993)
J. Phys. Chem.
, vol.97
, pp. 5839
-
-
Andrews, L.1
Hassanzadeh, P.2
Martin, J.M.L.3
Taylor, P.R.4
-
24
-
-
0038731169
-
-
(Cr)
-
Huang, Z.; Zeng, A.; Dong, J.; Zhou, M. J. Phys. Chem. A 2003, 107, 2329 (Cr)
-
(2003)
J. Phys. Chem. A
, vol.107
, pp. 2329
-
-
Huang, Z.1
Zeng, A.2
Dong, J.3
Zhou, M.4
-
25
-
-
0000336233
-
-
(Fe)
-
Kline, E. S.; Kafafi, Z. H.; Hauge, R. H.; Margrave, J. L. J. Am. Chem. Soc. 1985, 107, 7559 (Fe)
-
(1985)
J. Am. Chem. Soc.
, vol.107
, pp. 7559
-
-
Kline, E.S.1
Kafafi, Z.H.2
Hauge, R.H.3
Margrave, J.L.4
-
26
-
-
28144435855
-
-
Pilme, J.; Silvi, B.; Alikhani, M. E. J. Phys. Chem. A 2005, 109, 10028
-
(2005)
J. Phys. Chem. A
, vol.109
, pp. 10028
-
-
Pilme, J.1
Silvi, B.2
Alikhani, M.E.3
-
27
-
-
0037992030
-
-
(Mn, theory)
-
Swope, W. C.; Schaefer, H. F., III Mol. Phys. 1977, 34, 1037 (Mn, theory)
-
(1977)
Mol. Phys.
, vol.34
, pp. 1037
-
-
Swope, W.C.1
Iii, F.S.H.2
-
28
-
-
33751025589
-
-
(Th, U)
-
Andrews, L.; Kushto, G. P.; Marsden, C. J. Chem. - Eur. J. 2006, 12, 8324 (Th, U)
-
(2006)
Chem. - Eur. J.
, vol.12
, pp. 8324
-
-
Andrews, L.1
Kushto, G.P.2
Marsden, C.J.3
-
32
-
-
35748982147
-
-
Lyon, J. T.; Cho, H.-G.; Andrews, L.; Hu, H.-S.; Li, J. Inorg. Chem. 2007, 46, 8728
-
(2007)
Inorg. Chem.
, vol.46
, pp. 8728
-
-
Lyon, J.T.1
Cho, H.-G.2
Andrews, L.3
Hu, H.-S.4
Li, J.5
-
33
-
-
0036555542
-
-
references therein
-
Andrews, L.; Citra, A. Chem. Rev. 2002, 102, 885 and references therein
-
(2002)
Chem. Rev.
, vol.102
, pp. 885
-
-
Andrews, L.1
Citra, A.2
-
34
-
-
1642302115
-
-
references therein
-
Andrews, L. Chem. Soc. Rev. 2004, 33, 123 and references therein
-
(2004)
Chem. Soc. Rev.
, vol.33
, pp. 123
-
-
Andrews, L.1
-
35
-
-
0034287504
-
-
references therein
-
Andrews, L.; Zhou, M. F.; Wang, X.; Bauschlicher, C. W., Jr. J. Phys. Chem. A 2000, 104, 8887 and references therein
-
(2000)
J. Phys. Chem. A
, vol.104
, pp. 8887
-
-
Andrews, L.1
Zhou, M.F.2
Wang, X.3
Bauschlicher Jr., C.W.4
-
37
-
-
70450206724
-
-
revision A.02; Gaussian, Inc.: Wallingford, CT.
-
Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Scuseria, G. E.; Robb, M. A.; Cheeseman, J. R.; Scalmani, G.; Barone, V.; Mennucci, B.; Petersson, G. A.; Nakatsuji, H.; Caricato, M.; Li, X.; Hratchian, H. P.; Izmaylov, A. F.; Bloino, J.; Zheng, G.; Sonnenberg, J. L.; Hada, M.; Ehara, M.; Toyota, K.; Fukuda, R.; Hasegawa, J.; Ishida, M.; Nakajima, T.; Honda, Y.; Kitao, O.; Nakai, H.; Vreven, T.; Montgomery, J. A., Jr.; Peralta, J. E.; Ogliaro, F.; Bearpark, M.; Heyd, J. J.; Brothers, E.; Kudin, K. N.; Staroverov, V. N.; Kobayashi, R.; Normand, J.; Raghavachari, K.; Rendell, A.; Burant, J. C.; Iyengar, S. S.; Tomasi, J.; Cossi, M.; Rega, N.; Millam, J. M.; Klene, M.; Knox, J. E.; Cross, J. B.; Bakken, V.; Adamo, C.; Jaramillo, J.; Gomperts, R.; Stratmann, R. E.; Yazyev, O.; Austin, A. J.; Cammi, R.; Pomelli, C.; Ochterski, J. W.; Martin, R. L.; Morokuma, K.; Zakrzewski, V. G.; Voth, G. A.; Salvador, P.; Dannenberg, J. J.; Dapprich, S.; Daniels, A. D.; Farkas, O.; Foresman, J. B.; Ortiz, J. V.; Cioslowski, J.; Fox, D. J. Gaussian 09, revision A.02; Gaussian, Inc.: Wallingford, CT, 2009.
-
(2009)
Gaussian 09
-
-
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..
-
39
-
-
0345491105
-
-
Lee, C.; Yang, Y.; Parr, R. G. Phys. Rev. B 1988, 37, 785
-
(1988)
Phys. Rev. B
, vol.37
, pp. 785
-
-
Lee, C.1
Yang, Y.2
Parr, R.G.3
-
40
-
-
11744322674
-
-
Andrae, D.; Haeussermann, U.; Dolg, M.; Stoll, H.; Preuss, H. Theor. Chim. Acta 1990, 77, 123
-
(1990)
Theor. Chim. Acta
, vol.77
, pp. 123
-
-
Andrae, D.1
Haeussermann, U.2
Dolg, M.3
Stoll, H.4
Preuss, H.5
-
41
-
-
0003454331
-
-
In;;;, Ed.; Plenum: New York.
-
Burke, K.; Perdew, J. P.; Wang, Y. In Electronic Density Functional Theory: Recent Progress and New Directions; Dobson, J. F.; Vignale, G.; Das, M. P., Ed.; Plenum: New York, 1998.
-
(1998)
Electronic Density Functional Theory: Recent Progress and New Directions
-
-
Burke, K.1
Perdew, J.P.2
Wang, Y.3
Dobson, J.F.4
Vignale, G.5
Das, M.P.6
-
43
-
-
0000138315
-
-
Billups, W. E.; Konarski, M. M.; Hauge, R. H.; Margrave, J. L. J. Am. Chem. Soc. 1980, 102, 7394
-
(1980)
J. Am. Chem. Soc.
, vol.102
, pp. 7394
-
-
Billups, W.E.1
Konarski, M.M.2
Hauge, R.H.3
Margrave, J.L.4
-
48
-
-
0011083499
-
-
references therein
-
Reed, A. E.; Curtiss, L. A.; Weinhold, F. Chem. Rev. 1988, 88, 899 and references therein
-
(1988)
Chem. Rev.
, vol.88
, pp. 899
-
-
Reed, A.E.1
Curtiss, L.A.2
Weinhold, F.3
-
49
-
-
0000762166
-
-
Landis, C. R.; Cleveland, T.; Fireman, T. K. J. Am. Chem. Soc. 1995, 1117, 1859
-
(1995)
J. Am. Chem. Soc.
, vol.1117
, pp. 1859
-
-
Landis, C.R.1
Cleveland, T.2
Fireman, T.K.3
|