-
1
-
-
0001674068
-
-
10.1063/1.440457
-
R. F. W. Bader, J. Chem. Phys. 73, 2871 (1980). 10.1063/1.440457
-
(1980)
J. Chem. Phys.
, vol.73
, pp. 2871
-
-
Bader, R.F.W.1
-
4
-
-
84899860636
-
-
in, edited by W. F. Kuhs (Royal Society of Chemistry, Cambridge)
-
S. Jenkins, S. R. Kirk, and P. W. Ayers, in Physics and Chemistry of Ice, edited by, W. F. Kuhs, (Royal Society of Chemistry, Cambridge, 2007), p. 249.
-
(2007)
Physics and Chemistry of Ice
, pp. 249
-
-
Jenkins, S.1
Kirk, S.R.2
Ayers, P.W.3
-
5
-
-
84899819943
-
-
in, edited by W. F. Kuhs (Royal Society of Chemistry, Cambridge)
-
S. Jenkins, S. R. Kirk, and P. W. Ayers, in Physics and Chemistry of Ice, edited by, W. F. Kuhs, (Royal Society of Chemistry, Cambridge, 2007), p. 273.
-
(2007)
Physics and Chemistry of Ice
, pp. 273
-
-
Jenkins, S.1
Kirk, S.R.2
Ayers, P.W.3
-
6
-
-
0042205611
-
-
10.1139/p03-007
-
S. Jenkins, S. R. Kirk, A. S. Cote, D. K. Ross, and I. Morrison, Can. J. Phys. 81, 225 (2003). 10.1139/p03-007
-
(2003)
Can. J. Phys.
, vol.81
, pp. 225
-
-
Jenkins, S.1
Kirk, S.R.2
Cote, A.S.3
Ross, D.K.4
Morrison, I.5
-
7
-
-
0000673422
-
-
10.1021/jp984187g
-
A. Toro-Labbe, J. Phys. Chem. A 103, 4398 (1999). 10.1021/jp984187g
-
(1999)
J. Phys. Chem. A
, vol.103
, pp. 4398
-
-
Toro-Labbe, A.1
-
9
-
-
38849140426
-
A new perspective on chemical and physical processes: The reaction force
-
DOI 10.1080/00268970701604663, PII 783078099, A Special Issue in Honour of Professor Peter Pulay
-
A. Toro-Labbé, S. Gutierrerez-Oliva, J. S. Murray, and P. Politzer, Mol. Phys. 105, 2619 (2007). 10.1080/00268970701604663 (Pubitemid 351194977)
-
(2007)
Molecular Physics
, vol.105
, Issue.19-22
, pp. 2619-2625
-
-
Toro-Labbe, A.1
Gutierrez-Oliva, S.2
Murray, J.S.3
Politzer, P.4
-
10
-
-
68249088539
-
-
in, edited by P. K. Chattaraj (CRC, Boca Raton)
-
A. Toro-Labbe, S. Gutierrerez-Oliva, P. Politzer, and J. S. Murray, in Chemical Reactivity Theory: A Density Functional View, edited by, P. K. Chattaraj, (CRC, Boca Raton, 2009), p. 293.
-
(2009)
Chemical Reactivity Theory: A Density Functional View
, pp. 293
-
-
Toro-Labbe, A.1
Gutierrerez-Oliva, S.2
Politzer, P.3
Murray, J.S.4
-
11
-
-
27844587775
-
-
10.1007/BF02708350
-
P. Politzer, A. Toro-Labbe, S. Gutierrez-Oliva, B. Herrera, P. Jaque, M. C. Concha, and J. S. Murray, J. Chem. Sci. 117, 467 (2005). 10.1007/BF02708350
-
(2005)
J. Chem. Sci.
, vol.117
, pp. 467
-
-
Politzer, P.1
Toro-Labbe, A.2
Gutierrez-Oliva, S.3
Herrera, B.4
Jaque, P.5
Concha, M.C.6
Murray, J.S.7
-
18
-
-
84980105804
-
-
10.1002/and19273870211
-
E. Schrdinger, Ann. Phys. 387, 265 (1927). 10.1002/andp.19273870211
-
(1927)
Ann. Phys.
, vol.387
, pp. 265
-
-
Schrdinger, E.1
-
20
-
-
0010054154
-
-
10.1063/1.431797
-
S. T. Epstein, J. Chem. Phys. 63, 3573 (1975). 10.1063/1.431797
-
(1975)
J. Chem. Phys.
, vol.63
, pp. 3573
-
-
Epstein, S.T.1
-
22
-
-
0005941624
-
-
10.1080/00268977800101011
-
B. M. Deb and A. S. Bamzai, Mol. Phys. 35, 1349 (1978). 10.1080/00268977800101011
-
(1978)
Mol. Phys.
, vol.35
, pp. 1349
-
-
Deb, B.M.1
Bamzai, A.S.2
-
23
-
-
84926268037
-
-
10.1080/00268977900103061
-
B. M. Deb and A. S. Bamzai, Mol. Phys. 38, 2069 (1979). 10.1080/00268977900103061
-
(1979)
Mol. Phys.
, vol.38
, pp. 2069
-
-
Deb, B.M.1
Bamzai, A.S.2
-
24
-
-
0039644153
-
-
10.1088/0022-3700/12/23/013
-
B. M. Deb and S. K. Ghosh, J. Phys. B 12, 3857 (1979). 10.1088/0022-3700/12/23/013
-
(1979)
J. Phys. B
, vol.12
, pp. 3857
-
-
Deb, B.M.1
Ghosh, S.K.2
-
29
-
-
0001718557
-
-
10.1103/PhysRevA.51.2040
-
A. Holas and N. H. March, Phys. Rev. A 51, 2040 (1995). 10.1103/PhysRevA.51.2040
-
(1995)
Phys. Rev. A
, vol.51
, pp. 2040
-
-
Holas, A.1
March, N.H.2
-
30
-
-
85047695694
-
-
10.1080/00268979709482750
-
A. Nagy and N. H. March, Mol. Phys. 91, 597 (1997). 10.1080/ 00268979709482750
-
(1997)
Mol. Phys.
, vol.91
, pp. 597
-
-
Nagy, A.1
March, N.H.2
-
31
-
-
36149029794
-
-
10.1088/0953-4075/23/15/011
-
M. J. Godfrey, J. Phys. B 23, 2427 (1990). 10.1088/0953-4075/23/15/011
-
(1990)
J. Phys. B
, vol.23
, pp. 2427
-
-
Godfrey, M.J.1
-
32
-
-
79952668955
-
-
10.1021/jp109804y
-
D. J. Henry, P. Szarek, K. Hirai, K. Ichikawa, A. Tachibana, and I. Yarovsky, J. Phys. Chem. C 115, 1714 (2011). 10.1021/jp109804y
-
(2011)
J. Phys. Chem. C
, vol.115
, pp. 1714
-
-
Henry, D.J.1
Szarek, P.2
Hirai, K.3
Ichikawa, K.4
Tachibana, A.5
Yarovsky, I.6
-
33
-
-
79958850000
-
-
S. Jenkins, S. R. Kirk, A. Guevara-Garca, P. W. Ayers, E. Echegaray, and A. Toro-Labbe, Chem. Phys. Lett. 510, 18 (2011).
-
(2011)
Chem. Phys. Lett.
, vol.510
, pp. 18
-
-
Jenkins, S.1
Kirk, S.R.2
Guevara-Garca, A.3
Ayers, P.W.4
Echegaray, E.5
Toro-Labbe, A.6
-
34
-
-
77954952410
-
-
10.1016/j.theochem.2010.04.007
-
K. Ichikawa, A. Wagatsuma, M. Kusumoto, and A. Tachibana, J. Mol. Struct.: THEOCHEM 951, 49 (2010). 10.1016/j.theochem.2010.04.007
-
(2010)
J. Mol. Struct.: THEOCHEM
, vol.951
, pp. 49
-
-
Ichikawa, K.1
Wagatsuma, A.2
Kusumoto, M.3
Tachibana, A.4
-
35
-
-
0035934134
-
Electronic energy density in chemical reaction systems
-
DOI 10.1063/1.1384012
-
A. Tachibana, J. Chem. Phys. 115, 3497 (2001). 10.1063/1.1384012 (Pubitemid 32795662)
-
(2001)
Journal of Chemical Physics
, vol.115
, Issue.8
, pp. 3497-3518
-
-
Tachibana, A.1
-
36
-
-
0037100746
-
-
10.1063/1.1484385
-
A. M. Pendas, J. Chem. Phys. 117, 965 (2002). 10.1063/1.1484385
-
(2002)
J. Chem. Phys.
, vol.117
, pp. 965
-
-
Pendas, A.M.1
-
37
-
-
65649085571
-
-
10.1016/S0065-3276(09)00613-3
-
R. F. W. Bader, Adv. Quantum Chem. 57, 285 (2009). 10.1016/S0065-3276(09) 00613-3
-
(2009)
Adv. Quantum Chem.
, vol.57
, pp. 285
-
-
Bader, R.F.W.1
-
39
-
-
76349087363
-
-
10.1016/j.theochem.2009.11.018
-
A. Tachibana, J. Mol. Struct.: THEOCHEM 943, 138 (2010). 10.1016/j.theochem.2009.11.018
-
(2010)
J. Mol. Struct.: THEOCHEM
, vol.943
, pp. 138
-
-
Tachibana, A.1
-
40
-
-
71549125898
-
-
10.1103/PhysRevA.80.062507
-
K. Ichikawa and A. Tachibana, Phys. Rev. A 80, 062507 (2009). 10.1103/PhysRevA.80.062507
-
(2009)
Phys. Rev. A
, vol.80
, pp. 062507
-
-
Ichikawa, K.1
Tachibana, A.2
-
42
-
-
27844601162
-
A new visualization scheme of chemical energy density and bonds in molecules
-
DOI 10.1007/s00894-005-0260-y
-
A. Tachibana, J. Mol. Model. 11, 301 (2005). 10.1007/s00894-005-0260-y (Pubitemid 41644663)
-
(2005)
Journal of Molecular Modeling
, vol.11
, Issue.4-5
, pp. 301-311
-
-
Tachibana, A.1
-
43
-
-
15744390877
-
Spindle structure of the stress tensor of chemical bond
-
DOI 10.1002/qua.20258
-
A. Tachibana, Int. J. Quantum Chem. 100, 981 (2004). 10.1002/qua.20258 (Pubitemid 40760842)
-
(2004)
International Journal of Quantum Chemistry
, vol.100
, Issue.6
, pp. 981-993
-
-
Tachibana, A.1
-
45
-
-
33845869849
-
-
10.1039/b604996f
-
J. Hernandez-Trujillo, F. Cortes-Guzman, D. C. Fang, and R. F. W. Bader, Faraday Discuss. 135, 79 (2007). 10.1039/b604996f
-
(2007)
Faraday Discuss.
, vol.135
, pp. 79
-
-
Hernandez-Trujillo, J.1
Cortes-Guzman, F.2
Fang, D.C.3
Bader, R.F.W.4
-
47
-
-
34347404086
-
The field theoretical study of chemical interaction in terms of the Rigged QED: New reactivity indices
-
DOI 10.1007/s00894-007-0215-6, International conference and workshop: Modeling and Design of Molecular Materials, 10-15 September 2006, Wrocklaw, Poland
-
P. Szarek and A. Tachibana, J. Mol. Model. 13, 651 (2007). 10.1007/s00894-007-0215-6 (Pubitemid 47023389)
-
(2007)
Journal of Molecular Modeling
, vol.13
, Issue.6-7
, pp. 651-663
-
-
Szarek, P.1
Tachibana, A.2
-
48
-
-
84920920971
-
Electronic stress as a guiding force for chemical bonding
-
(to be published).
-
A. Guevara-Garca, P. W. Ayers, S. Jenkins, S. R. Kirk, E. Echegaray, and A. Toro-Labbe, Electronic stress as a guiding force for chemical bonding., Top. Curr. Chem. (to be published).
-
Top. Curr. Chem.
-
-
Guevara-Garca, A.1
Ayers, P.W.2
Jenkins, S.3
Kirk, S.R.4
Echegaray, E.5
Toro-Labbe, A.6
-
49
-
-
44249098763
-
Quantum stress focusing in descriptive chemistry
-
DOI 10.1103/PhysRevLett.100.206405
-
J. M. Tao, G. Vignale, and I. V. Tokatly, Phys. Rev. Lett. 100, 206405 (2008). 10.1103/PhysRevLett.100.206405 (Pubitemid 351725948)
-
(2008)
Physical Review Letters
, vol.100
, Issue.20
, pp. 206405
-
-
Tao, J.1
Vignale, G.2
Tokatly, I.V.3
-
52
-
-
33845805237
-
Quantum notions of stress
-
DOI 10.1061/(ASCE)0893-1321(2007)20:1(22)
-
R. Maranganti, P. Sharma, and L. Wheeler, J. Aerosp. Eng. 20, 22 (2007). 10.1061/(ASCE)0893-1321(2007)20:1(22) (Pubitemid 44975013)
-
(2007)
Journal of Aerospace Engineering
, vol.20
, Issue.1
, pp. 22-37
-
-
Maranganti, R.1
Sharma, P.2
Wheeler, L.3
-
54
-
-
0006377431
-
-
10.1063/1.472913
-
H. Schmider, J. Chem. Phys. 105 (24), 11134 (1996). 10.1063/1.472913
-
(1996)
J. Chem. Phys.
, vol.105
, Issue.24
, pp. 11134
-
-
Schmider, H.1
-
56
-
-
27844549784
-
-
10.1007/BF02708348
-
P. W. Ayers, J. Chem. Sci. 117, 441 (2005). 10.1007/BF02708348
-
(2005)
J. Chem. Sci.
, vol.117
, pp. 441
-
-
Ayers, P.W.1
-
57
-
-
36549100828
-
-
10.1063/1.458435
-
J. Nichols, H. Taylor, P. Schmidt, and J. Simons, J. Chem. Phys. 92, 340 (1990). 10.1063/1.458435
-
(1990)
J. Chem. Phys.
, vol.92
, pp. 340
-
-
Nichols, J.1
Taylor, H.2
Schmidt, P.3
Simons, J.4
-
58
-
-
0039047376
-
-
10.1021/j100247a015
-
A. Banerjee, N. Adams, J. Simons, and R. Shepard, J. Phys. Chem. 89, 52 (1985). 10.1021/j100247a015
-
(1985)
J. Phys. Chem.
, vol.89
, pp. 52
-
-
Banerjee, A.1
Adams, N.2
Simons, J.3
Shepard, R.4
-
59
-
-
4243124919
-
-
10.1021/j100238a013
-
J. Simons, P. Jorgensen, H. Taylor, and J. Ozment, J. Phys. Chem. 87, 2745 (1983). 10.1021/j100238a013
-
(1983)
J. Phys. Chem.
, vol.87
, pp. 2745
-
-
Simons, J.1
Jorgensen, P.2
Taylor, H.3
Ozment, J.4
-
60
-
-
0001878056
-
-
10.1021/ja00808a004
-
H. Nakatsuji, J. Am. Chem. Soc. 96, 24 (1974). 10.1021/ja00808a004
-
(1974)
J. Am. Chem. Soc.
, vol.96
, pp. 24
-
-
Nakatsuji, H.1
-
61
-
-
0002756873
-
-
10.1021/ja00808a005
-
H. Nakatsuji, J. Am. Chem. Soc. 96, 30 (1974). 10.1021/ja00808a005
-
(1974)
J. Am. Chem. Soc.
, vol.96
, pp. 30
-
-
Nakatsuji, H.1
-
62
-
-
33846137313
-
-
10.1016/S0065-3276(06)51006-8
-
R. F. Nalewajski, Adv. Quantum Chem. 51, 235 (2006). 10.1016/S0065- 3276(06)51006-8
-
(2006)
Adv. Quantum Chem.
, vol.51
, pp. 235
-
-
Nalewajski, R.F.1
-
63
-
-
34250930798
-
-
10.1007/BF01329203
-
P. Ehrenfest, Z. Phys. A 45, 455 (1927). 10.1007/BF01329203
-
(1927)
Z. Phys. A
, vol.45
, pp. 455
-
-
Ehrenfest, P.1
-
64
-
-
0036612535
-
-
10.1103/PhysRevB.65.224117
-
C. L. Rogers and A. M. Rappe, Phys. Rev. B 65, 224117 (2002). 10.1103/PhysRevB.65.224117
-
(2002)
Phys. Rev. B
, vol.65
, pp. 224117
-
-
Rogers, C.L.1
Rappe, A.M.2
-
65
-
-
0000087088
-
-
10.1103/PhysRevB.37.10176
-
M. J. Godfrey, Phys. Rev. B 37, 10176 (1988). 10.1103/PhysRevB.37.10176
-
(1988)
Phys. Rev. B
, vol.37
, pp. 10176
-
-
Godfrey, M.J.1
-
66
-
-
33746471209
-
The stress tensor of a molecular system: An exercise in statistical mechanics
-
DOI 10.1063/1.2214719
-
S. Morante, G. C. Rossi, and M. Testa, J. Chem. Phys. 125, 034101 (2006). 10.1063/1.2214719 (Pubitemid 44121200)
-
(2006)
Journal of Chemical Physics
, vol.125
, Issue.3
, pp. 034101
-
-
Morante, S.1
Rossi, G.C.2
Testa, M.3
-
67
-
-
4243349683
-
-
10.1103/PhysRevB.13.1770
-
D. F. Nelson and M. Lax, Phys. Rev. B 13, 1770 (1976). 10.1103/PhysRevB.13.1770
-
(1976)
Phys. Rev. B
, vol.13
, pp. 1770
-
-
Nelson, D.F.1
Lax, M.2
-
68
-
-
0038652709
-
-
10.1103/PhysRevD.18.2065
-
A. Das, Phys. Rev. D 18, 2065 (1978). 10.1103/PhysRevD.18.2065
-
(1978)
Phys. Rev. D
, vol.18
, pp. 2065
-
-
Das, A.1
-
69
-
-
0000817505
-
-
10.1063/1.437511
-
L. Cohen, J. Chem. Phys. 70, 788 (1979). 10.1063/1.437511
-
(1979)
J. Chem. Phys.
, vol.70
, pp. 788
-
-
Cohen, L.1
-
70
-
-
0010407614
-
-
10.1063/1.447257
-
L. Cohen, J. Chem. Phys. 80, 4277 (1984). 10.1063/1.447257
-
(1984)
J. Chem. Phys.
, vol.80
, pp. 4277
-
-
Cohen, L.1
-
72
-
-
0002773239
-
-
10.1016/0166-1280(91)89007-N
-
R. F. W. Bader and K. E. Laidig, THEOCHEM 80, 75 (1991). 10.1016/0166-1280(91)89007-N
-
(1991)
THEOCHEM
, vol.80
, pp. 75
-
-
Bader, R.F.W.1
Laidig, K.E.2
-
73
-
-
0000495334
-
-
10.1063/1.438006
-
R. F. W. Bader, T. T. Nguyendang, and Y. Tal, J. Chem. Phys. 70 (9), 4316 (1979). 10.1063/1.438006
-
(1979)
J. Chem. Phys.
, vol.70
, Issue.9
, pp. 4316
-
-
Bader, R.F.W.1
Nguyendang, T.T.2
Tal, Y.3
-
74
-
-
0001011577
-
-
10.1021/ja00500a006
-
R. F. W. Bader, S. G. Anderson, and A. J. Duke, J. Am. Chem. Soc. 101 (6), 1389 (1979). 10.1021/ja00500a006
-
(1979)
J. Am. Chem. Soc.
, vol.101
, Issue.6
, pp. 1389
-
-
Bader, R.F.W.1
Anderson, S.G.2
Duke, A.J.3
-
75
-
-
0002854856
-
-
R. F. W. Bader, Y. Tal, S. G. Anderson, and T. T. Nguyen-Dang, Isr. J. Chem. 19, 8 (1980).
-
(1980)
Isr. J. Chem.
, vol.19
, pp. 8
-
-
Bader, R.F.W.1
Tal, Y.2
Anderson, S.G.3
Nguyen-Dang, T.T.4
-
76
-
-
0000590075
-
-
10.1063/1.441725
-
Y. Tal, R. F. W. Bader, T. T. Nguyendang, M. Ojha, and S. G. Anderson, J. Chem. Phys. 74, 5162 (1981). 10.1063/1.441725
-
(1981)
J. Chem. Phys.
, vol.74
, pp. 5162
-
-
Tal, Y.1
Bader, R.F.W.2
Nguyendang, T.T.3
Ojha, M.4
Anderson, S.G.5
-
77
-
-
4243553426
-
-
10.1103/PhysRevA.38.3098
-
A. D. Becke, Phys. Rev. A 38, 3098 (1988). 10.1103/PhysRevA.38.3098
-
(1988)
Phys. Rev. A
, vol.38
, pp. 3098
-
-
Becke, A.D.1
-
78
-
-
0000189651
-
-
10.1063/1.464913
-
A. D. Becke, J. Chem. Phys. 98, 5648 (1993). 10.1063/1.464913
-
(1993)
J. Chem. Phys.
, vol.98
, pp. 5648
-
-
Becke, A.D.1
-
80
-
-
0038596731
-
-
10.1016/0009-2614(89)87234-3
-
B. Miehlich, A. Savin, H. Stoll, and H. Preuss, Chem. Phys. Lett. 157 (3), 200 (1989). 10.1016/0009-2614(89)87234-3
-
(1989)
Chem. Phys. Lett.
, vol.157
, Issue.3
, pp. 200
-
-
Miehlich, B.1
Savin, A.2
Stoll, H.3
Preuss, H.4
-
81
-
-
79959725551
-
-
GAUSSIAN 03, Revision D.01, Gaussian, Inc., Wallingford, CT.
-
M. J. Frisch, G. W. Trucks, H. B. Schlegel, GAUSSIAN 03, Revision D.01, Gaussian, Inc., Wallingford, CT, 2004.
-
(2004)
-
-
Frisch, M.J.1
Trucks, G.W.2
Schlegel, H.B.3
-
82
-
-
79959697560
-
-
aimall version 09.04.23, see.
-
T. A. Keith, aimall version 09.04.23, see http://aim.tkgristmill.com, 2009.
-
(2009)
-
-
Keith, T.A.1
-
83
-
-
32444448669
-
A Hamilton-Jacobi type equation for computing minimum potential energy paths
-
DOI 10.1080/00268970500460390, PII Q640027354274
-
B. K. Dey and P. W. Ayers, Mol. Phys. 104, 541 (2006). 10.1080/00268970500460390 (Pubitemid 43224165)
-
(2006)
Molecular Physics
, vol.104
, Issue.4
, pp. 541-558
-
-
Dey, B.K.1
Ayers, P.W.2
-
84
-
-
33847283956
-
Computing tunneling paths with the Hamilton-Jacobi equation and the fast marching method
-
DOI 10.1080/00268970601131999, PII 771220156
-
B. K. Dey and P. W. Ayers, Mol. Phys. 105, 71 (2007). 10.1080/00268970601131999 (Pubitemid 46326983)
-
(2007)
Molecular Physics
, vol.105
, Issue.1
, pp. 71-83
-
-
Dey, B.K.1
Ayers, P.W.2
-
88
-
-
14844358229
-
On the mechanism of Hydrogen transfer in the HSCH(O) ⇄ (S)CHOH and HSNO ⇄ SNOH reactions
-
DOI 10.1021/jp0452756
-
S. Gutierrrez-Oliva, B. Herrera, A. Toro-Labbe, and H. Chermette, J. Phys. Chem. A 109, 1748 (2005). 10.1021/jp0452756 (Pubitemid 40352370)
-
(2005)
Journal of Physical Chemistry A
, vol.109
, Issue.8
, pp. 1748-1751
-
-
Gutierrez-Oliva, S.1
Herrera, B.2
Toro-Labbe, A.3
Chermette, H.4
-
89
-
-
33751044609
-
-
10.1021/ar00072a001
-
K. Fukui, Acc. Chem. Res. 14 (12), 363 (1981). 10.1021/ar00072a001
-
(1981)
Acc. Chem. Res.
, vol.14
, Issue.12
, pp. 363
-
-
Fukui, K.1
-
91
-
-
72749120436
-
-
Computational Methods in Science and Engineering, edited by G. Maroulis and T. E. Simos, Theory and Computation: Old Problems and New Challenges Vol. 1
-
P. Flores, S. Gutierrez-Oliva, B. Herrera, E. Silva, and A. Toro-Labbe, Computational Methods in Science and Engineering, edited by, G. Maroulis, and, T. E. Simos, Theory and Computation: Old Problems and New Challenges Vol. 1, (2007), p. 345.
-
(2007)
, pp. 345
-
-
Flores, P.1
Gutierrez-Oliva, S.2
Herrera, B.3
Silva, E.4
Toro-Labbe, A.5
-
94
-
-
34547433139
-
The role of reaction force and chemical potential in characterizing the mechanism of double proton transfer in the adenine-uracil complex
-
DOI 10.1021/jp065951z
-
B. Herrera and A. Toro-Labbé, J. Phys. Chem. A 111 (26), 5921 (2007). 10.1021/jp065951z (Pubitemid 47166796)
-
(2007)
Journal of Physical Chemistry A
, vol.111
, Issue.26
, pp. 5921-5926
-
-
Herrera, B.1
Toro-Labbe, A.2
-
95
-
-
4544385268
-
-
10.1063/1.1777216
-
A. Toro-Labbé, S. Gutierrez-Oliva, M. C. Concha, J. S. Murray, and P. Politzer, J. Chem. Phys. 121, 4570 (2004). 10.1063/1.1777216
-
(2004)
J. Chem. Phys.
, vol.121
, pp. 4570
-
-
Toro-Labbé, A.1
Gutierrez-Oliva, S.2
Concha, M.C.3
Murray, J.S.4
Politzer, P.5
-
98
-
-
70349240342
-
-
10.1021/jp906341r
-
R. F. W. Bader, J. Phys. Chem. A 113, 10391 (2009). 10.1021/jp906341r
-
(2009)
J. Phys. Chem. A
, vol.113
, pp. 10391
-
-
Bader, R.F.W.1
-
100
-
-
70349786459
-
-
10.1002/anie.200805751
-
S. Grimme, C. Muck-Lichtenfeld, G. Erker, G. Kehr, H. D. Wang, H. Beckers, and H. Willner, Angew. Chem., Int. Ed. 48, 2592 (2009). 10.1002/anie.200805751
-
(2009)
Angew. Chem., Int. Ed.
, vol.48
, pp. 2592
-
-
Grimme, S.1
Muck-Lichtenfeld, C.2
Erker, G.3
Kehr, G.4
Wang, H.D.5
Beckers, H.6
Willner, H.7
-
101
-
-
60749091755
-
-
10.1002/chem.200801399
-
E. Cerpa, A. Krapp, R. Flores-Moreno, K. J. Donald, and G. Merino, Chem.-Eur. J. 15, 1985 (2009). 10.1002/chem.200801399
-
(2009)
Chem.-Eur. J.
, vol.15
, pp. 1985
-
-
Cerpa, E.1
Krapp, A.2
Flores-Moreno, R.3
Donald, K.J.4
Merino, G.5
-
102
-
-
56349171200
-
-
10.1002/chem.200800934
-
E. Cerpa, A. Krapp, A. Vela, and G. Merino, Chem.-Eur. J. 14, 10232 (2008). 10.1002/chem.200800934
-
(2008)
Chem.-Eur. J.
, vol.14
, pp. 10232
-
-
Cerpa, E.1
Krapp, A.2
Vela, A.3
Merino, G.4
-
103
-
-
0020793405
-
-
10.1021/ja00353a035
-
R. F. W. Bader, T. S. Slee, D. Cremer, and E. Kraka, J. Am. Chem. Soc. 105, 5061 (1983). 10.1021/ja00353a035
-
(1983)
J. Am. Chem. Soc.
, vol.105
, pp. 5061
-
-
Bader, R.F.W.1
Slee, T.S.2
Cremer, D.3
Kraka, E.4
-
104
-
-
0000318804
-
-
10.1021/ic00088a011
-
R. J. Gillespie, I. Bytheway, R. S. Dewitte, and R. F. W. Bader, Inorg. Chem. 33, 2115 (1994). 10.1021/ic00088a011
-
(1994)
Inorg. Chem.
, vol.33
, pp. 2115
-
-
Gillespie, R.J.1
Bytheway, I.2
Dewitte, R.S.3
Bader, R.F.W.4
|