-
1
-
-
10644250257
-
-
PRVBAK 0096-8269 10.1103/PhysRev.136.B864
-
P. Hohenberg and W. Kohn, Phys. Rev. PRVBAK 0096-8269 10.1103/PhysRev.136.B864 136, B864 (1964).
-
(1964)
Phys. Rev.
, vol.136
, pp. 864
-
-
Hohenberg, P.1
Kohn, W.2
-
2
-
-
0042113153
-
-
PRVAAH 0096-8250 10.1103/PhysRev.140.A1133
-
W. Kohn and L. J. Sham, Phys. Rev. PRVAAH 0096-8250 10.1103/PhysRev.140. A1133 140, A1133 (1965).
-
(1965)
Phys. Rev.
, vol.140
, pp. 1133
-
-
Kohn, W.1
Sham, L.J.2
-
3
-
-
18144378706
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.33.8800
-
J. P. Perdew and Y. Wang, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.33.8800 33, R8800 (1986).
-
(1986)
Phys. Rev. B
, vol.33
, pp. 8800
-
-
Perdew, J.P.1
Wang, Y.2
-
4
-
-
0002851019
-
-
edited by P. Ziesche and H. Eschrig (Akademie-Verlag, Berlin
-
J. P. Perdew, in Electronic Structure of Solids '91, edited by, P. Ziesche, and, H. Eschrig, (Akademie-Verlag, Berlin, 1991), p. 11.
-
(1991)
Electronic Structure of Solids '91
, pp. 11
-
-
Perdew, J.P.1
-
5
-
-
23244460838
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.46.6671
-
J. P. Perdew, J. A. Chevary, S. H. Vosko, K. A. Jackson, M. R. Pederson, D. J. Singh, and C. Fiolhais, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.46. 6671 46, 6671 (1992).
-
(1992)
Phys. Rev. B
, vol.46
, pp. 6671
-
-
Perdew, J.P.1
Chevary, J.A.2
Vosko, S.H.3
Jackson, K.A.4
Pederson, M.R.5
Singh, D.J.6
Fiolhais, C.7
-
6
-
-
0001040318
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.55.R10157
-
D. R. Hamann, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.55.R10157 55, R10157 (1997).
-
(1997)
Phys. Rev. B
, vol.55
, pp. 10157
-
-
Hamann, D.R.1
-
7
-
-
0001437312
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.44.4032
-
K. Rapcewicz and N. W. Ashcroft, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.44.4032 44, 4032 (1991).
-
(1991)
Phys. Rev. B
, vol.44
, pp. 4032
-
-
Rapcewicz, K.1
Ashcroft, N.W.2
-
8
-
-
0001401905
-
-
PRLTAO 0031-9007 10.1103/PhysRevLett.82.2123
-
J. F. Dobson and J. Wang, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.82.2123 82, 2123 (1999).
-
(1999)
Phys. Rev. Lett.
, vol.82
, pp. 2123
-
-
Dobson, J.F.1
Wang, J.2
-
9
-
-
0002548086
-
-
JCCHDD 0192-8651 10.1002/(SICI)1096-987X(19990115)20:1<12::AID- JCC4>3.0.CO;2-U
-
M. Lein, J. F. Dobson, and E. K. U. Gross, J. Comput. Chem. JCCHDD 0192-8651 10.1002/(SICI)1096-987X(19990115)20:1<12::AID-JCC4>3.0.CO;2-U 20, 12 (1999).
-
(1999)
J. Comput. Chem.
, vol.20
, pp. 12
-
-
Lein, M.1
Dobson, J.F.2
Gross, E.K.U.3
-
10
-
-
0001437377
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.59.4708
-
E. Hult, H. Rydberg, B. I. Lundqvist, and D. C. Langreth, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.59.4708 59, 4708 (1999).
-
(1999)
Phys. Rev. B
, vol.59
, pp. 4708
-
-
Hult, E.1
Rydberg, H.2
Lundqvist, B.I.3
Langreth, D.C.4
-
11
-
-
0035891051
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.64.195414
-
E. Hult, P. Hyldgaard, J. Rossmeisl, and B. I. Lundqvist, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.64.195414 64, 195414 (2001).
-
(2001)
Phys. Rev. B
, vol.64
, pp. 195414
-
-
Hult, E.1
Hyldgaard, P.2
Rossmeisl, J.3
Lundqvist, B.I.4
-
12
-
-
0039296588
-
-
edited by J. F. Dobson, G. Vignale, and M. P. Das (Plenum Press, New York
-
Y. Andersson, E. Hult, H. Rydberg, P. Apell, B. I. Lundqvist, and D. C. Langreth, in Electronic Density Functional Theory: Recent Progress and New Directions, edited by, J. F. Dobson,,, G. Vignale,, and, M. P. Das, (Plenum Press, New York, 1998), p. 243.
-
(1998)
Electronic Density Functional Theory: Recent Progress and New Directions
, pp. 243
-
-
Andersson, Y.1
Hult, E.2
Rydberg, H.3
Apell, P.4
Lundqvist, B.I.5
Langreth, D.C.6
-
14
-
-
33646768692
-
-
ZEPYAA 0044-3328 10.1007/BF01421741
-
F. London, Z. Phys. ZEPYAA 0044-3328 10.1007/BF01421741 63, 245 (1930).
-
(1930)
Z. Phys.
, vol.63
, pp. 245
-
-
London, F.1
-
15
-
-
0035932162
-
-
JCPSA6 0021-9606 10.1063/1.1329889
-
M. Elstner, P. Hobza, T. Fraunheim, S. Suhai, and E. Kaxiras, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1329889 114, 5149 (2001).
-
(2001)
J. Chem. Phys.
, vol.114
, pp. 5149
-
-
Elstner, M.1
Hobza, P.2
Fraunheim, T.3
Suhai, S.4
Kaxiras, E.5
-
16
-
-
0035891306
-
-
JCPSA6 0021-9606 10.1063/1.1412004
-
X. Wu, M. C. Vargas, S. Nayak, V. Lotrich, and G. Scoles, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1412004 115, 8748 (2001).
-
(2001)
J. Chem. Phys.
, vol.115
, pp. 8748
-
-
Wu, X.1
Vargas, M.C.2
Nayak, S.3
Lotrich, V.4
Scoles, G.5
-
17
-
-
0037039459
-
-
JCPSA6 0021-9606 10.1063/1.1424928
-
Q. Wu and W. Yang, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1424928 116, 515 (2002).
-
(2002)
J. Chem. Phys.
, vol.116
, pp. 515
-
-
Wu, Q.1
Yang, W.2
-
18
-
-
37649031058
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.70.205431
-
M. Hasegawa and K. Nishidate, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.70.205431 70, 205431 (R) (2004).
-
(2004)
Phys. Rev. B
, vol.70
, pp. 205431
-
-
Hasegawa, M.1
Nishidate, K.2
-
19
-
-
4043164887
-
-
JCCHDD 0192-8651 10.1002/jcc.20078
-
S. Grimme, J. Comput. Chem. JCCHDD 0192-8651 10.1002/jcc.20078 25, 1463 (2004).
-
(2004)
J. Comput. Chem.
, vol.25
, pp. 1463
-
-
Grimme, S.1
-
20
-
-
67349147115
-
-
JCTCCE 1549-9618
-
L. Zhechkov, T. Heine, S. Patchkovskii, G. Seifert, and H. A. Duarte, J. Chem. Theory Comput. JCTCCE 1549-9618 1, 841 (2005).
-
(2005)
J. Chem. Theory Comput.
, vol.1
, pp. 841
-
-
Zhechkov, L.1
Heine, T.2
Patchkovskii, S.3
Seifert, G.4
Duarte, H.A.5
-
21
-
-
24344462659
-
-
JPCBFK 1089-5647 10.1021/jp050121r
-
M. A. Neumann and M.-A. Perrin, J. Phys. Chem. B JPCBFK 1089-5647 10.1021/jp050121r 109, 15531 (2005).
-
(2005)
J. Phys. Chem. B
, vol.109
, pp. 15531
-
-
Neumann, M.A.1
Perrin, M.-A.2
-
23
-
-
13944281362
-
-
IJQCB2 0020-7608 10.1002/qua.20314
-
J. F. Dobson, J. Wang, B. P. Dinte, K. McLennan, and H. M. Le, Int. J. Quantum Chem. IJQCB2 0020-7608 10.1002/qua.20314 101, 579 (2005).
-
(2005)
Int. J. Quantum Chem.
, vol.101
, pp. 579
-
-
Dobson, J.F.1
Wang, J.2
Dinte, B.P.3
McLennan, K.4
Le, H.M.5
-
24
-
-
0001010885
-
-
JACSAT 0002-7863 10.1021/ja00046a032
-
T. A. Halgren, J. Am. Chem. Soc. JACSAT 0002-7863 10.1021/ja00046a032 114, 7827 (1992).
-
(1992)
J. Am. Chem. Soc.
, vol.114
, pp. 7827
-
-
Halgren, T.A.1
-
25
-
-
2442537377
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.54.11169
-
G. Kresse and J. Furthmüller, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.54.11169 54, 11169 (1996).
-
(1996)
Phys. Rev. B
, vol.54
, pp. 11169
-
-
Kresse, G.1
Furthmüller, J.2
-
26
-
-
0030190741
-
-
CMMSEM 0927-0256 10.1016/0927-0256(96)00008-0
-
G. Kresse and J. Furthmüller, Comput. Mater. Sci. CMMSEM 0927-0256 10.1016/0927-0256(96)00008-0 6, 15 (1996).
-
(1996)
Comput. Mater. Sci.
, vol.6
, pp. 15
-
-
Kresse, G.1
Furthmüller, J.2
-
27
-
-
26144450583
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.23.5048
-
J. P. Perdew and A. Zunger, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.23.5048 23, 5048 (1981).
-
(1981)
Phys. Rev. B
, vol.23
, pp. 5048
-
-
Perdew, J.P.1
Zunger, A.2
-
28
-
-
33744691386
-
-
PRLTAO 0031-9007 10.1103/PhysRevLett.45.566
-
D. M. Ceperley and B. J. Alder, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.45.566 45, 566 (1980).
-
(1980)
Phys. Rev. Lett.
, vol.45
, pp. 566
-
-
Ceperley, D.M.1
Alder, B.J.2
-
29
-
-
20544463457
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.41.7892
-
D. Vanderbilt, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.41.7892 41, R7892 (1990).
-
(1990)
Phys. Rev. B
, vol.41
, pp. 7892
-
-
Vanderbilt, D.1
-
30
-
-
0000079003
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.61.4576
-
J. Furthmüller, P. Käckell, F. Bechstedt, and G. Kresse, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.61.4576 61, 4576 (2000).
-
(2000)
Phys. Rev. B
, vol.61
, pp. 4576
-
-
Furthmüller, J.1
Käckell, P.2
Bechstedt, F.3
Kresse, G.4
-
31
-
-
0011236321
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.59.1758
-
G. Kresse and D. Joubert, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.59.1758 59, 1758 (1998).
-
(1998)
Phys. Rev. B
, vol.59
, pp. 1758
-
-
Kresse, G.1
Joubert, D.2
-
32
-
-
0346394774
-
-
JCCHDD 0192-8651 10.1002/jcc.10372
-
M. Preuss, W. G. Schmidt, K. Seino, J. Furthmüller, and F. Bechstedt, J. Comput. Chem. JCCHDD 0192-8651 10.1002/jcc.10372 25, 112 (2004).
-
(2004)
J. Comput. Chem.
, vol.25
, pp. 112
-
-
Preuss, M.1
Schmidt, W.G.2
Seino, K.3
Furthmüller, J.4
Bechstedt, F.5
-
33
-
-
0000549623
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.26.1738
-
S. G. Louie, S. Froyen, and M. L. Cohen, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.26.1738 26, 1738 (1982).
-
(1982)
Phys. Rev. B
, vol.26
, pp. 1738
-
-
Louie, S.G.1
Froyen, S.2
Cohen, M.L.3
-
34
-
-
0001368050
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.59.8551
-
G. Kern, G. Kresse, and J. Hafner, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.59.8551 59, 8551 (1999).
-
(1999)
Phys. Rev. B
, vol.59
, pp. 8551
-
-
Kern, G.1
Kresse, G.2
Hafner, J.3
-
35
-
-
0011807762
-
-
JGREA2 0148-0227 10.1063/1.1141509
-
F. Birch, J. Geophys. Res. JGREA2 0148-0227 10.1063/1.1141509 83, 1257 (1978).
-
(1978)
J. Geophys. Res.
, vol.83
, pp. 1257
-
-
Birch, F.1
-
38
-
-
1842816907
-
-
PLRBAQ 0556-2805 10.1103/PhysRevB.13.5188
-
H. J. Monkhorst and J. D. Pack, Phys. Rev. B PLRBAQ 0556-2805 10.1103/PhysRevB.13.5188 13, 5188 (1976).
-
(1976)
Phys. Rev. B
, vol.13
, pp. 5188
-
-
Monkhorst, H.J.1
Pack, J.D.2
-
40
-
-
36149017081
-
-
PHRVAO 0031-899X 10.1103/PhysRev.37.682
-
J. C. Slater and J. G. Kirkwood, Phys. Rev. PHRVAO 0031-899X 10.1103/PhysRev.37.682 37, 682 (1931).
-
(1931)
Phys. Rev.
, vol.37
, pp. 682
-
-
Slater, J.C.1
Kirkwood, J.G.2
-
41
-
-
0040360188
-
-
TCHAAM 0040-5744 10.1007/BF00573863
-
Y. K. Kang and M. S. Jhon, Theor. Chim. Acta TCHAAM 0040-5744 10.1007/BF00573863 61, 41 (1982).
-
(1982)
Theor. Chim. Acta
, vol.61
, pp. 41
-
-
Kang, Y.K.1
Jhon, M.S.2
-
42
-
-
0345720252
-
-
JACSAT 0002-7863 10.1021/ja00179a044
-
K. J. Miller, J. Am. Chem. Soc. JACSAT 0002-7863 10.1021/ja00179a044 112, 8533 (1990).
-
(1990)
J. Am. Chem. Soc.
, vol.112
, pp. 8533
-
-
Miller, K.J.1
-
43
-
-
51149210200
-
-
RMPHAT 0034-6861 10.1103/RevModPhys.61.689
-
R. O. Jones and O. Gunnarsson, Rev. Mod. Phys. RMPHAT 0034-6861 10.1103/RevModPhys.61.689 61, 689 (1989).
-
(1989)
Rev. Mod. Phys.
, vol.61
, pp. 689
-
-
Jones, R.O.1
Gunnarsson, O.2
-
45
-
-
0001373611
-
-
CMPHC2 0301-0104 10.1016/0301-0104(94)00342-8
-
R. Ahlrichs, R. Penco, and G. Scoles, Chem. Phys. CMPHC2 0301-0104 10.1016/0301-0104(94)00342-8 19, 119 (1977).
-
(1977)
Chem. Phys.
, vol.19
, pp. 119
-
-
Ahlrichs, R.1
Penco, R.2
Scoles, G.3
-
46
-
-
0033518333
-
-
JPCAFH 1089-5639 10.1021/jp991641n
-
W. T. M. Mooij, F. B. van Duijneveldt, J. G. C. M. van Duijneveldt-van de Rijdt, and B. P. van Eijck, J. Phys. Chem. A JPCAFH 1089-5639 10.1021/jp991641n 103, 9872 (1999).
-
(1999)
J. Phys. Chem. a
, vol.103
, pp. 9872
-
-
Mooij, W.T.M.1
Van Duijneveldt, F.B.2
Van Duijneveldt-Van De Rijdt, J.G.C.M.3
Van Eijck, B.P.4
-
48
-
-
19644400832
-
-
PRLTAO 0031-9007 10.1103/PhysRevLett.93.153004
-
O. A. von Lilienfeld, I. Tavernelli, U. Rothlisberger, and D. Sebastiani, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.93.153004 93, 153004 (2004).
-
(2004)
Phys. Rev. Lett.
, vol.93
, pp. 153004
-
-
Von Lilienfeld, O.A.1
Tavernelli, I.2
Rothlisberger, U.3
Sebastiani, D.4
-
49
-
-
0039155249
-
-
edited by K.-H. Hellwege Springer-Verlag, Berlin
-
Landolt-Börnstein: Numerical Data and Functional Relationships in Science and Technology, New Series Group III, edited by, K.-H. Hellwege, (Springer-Verlag, Berlin, 1982), Vol. 17a.
-
(1982)
Landolt-Börnstein: Numerical Data and Functional Relationships in Science and Technology, New Series Group III
, vol.17
-
-
-
50
-
-
0003395029
-
-
edited by K.-H. Hellwege Springer-Verlag, Berlin
-
Landolt-Börnstein: Numerical Data and Functional Relationships in Science and Technology, New Series Group III, edited by, K.-H. Hellwege, (Springer-Verlag, Berlin, 1973), Vol. 7.
-
(1973)
Landolt-Börnstein: Numerical Data and Functional Relationships in Science and Technology, New Series Group III
, vol.7
-
-
-
51
-
-
19044363895
-
-
edited by K.-H. Hellwege Springer-Verlag, Berlin
-
Landolt-Börnstein: Numerical Data and Functional Relationships in Science and Technology, New Series Group III, edited by, K.-H. Hellwege, (Springer-Verlag, Berlin, 1979), Vol. 11.
-
(1979)
Landolt-Börnstein: Numerical Data and Functional Relationships in Science and Technology, New Series Group III
, vol.11
-
-
-
52
-
-
33750999643
-
-
JCPSA6 0021-9606 10.1063/1.1701288
-
A. C. Victor, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1701288 36, 1903 (1962).
-
(1962)
J. Chem. Phys.
, vol.36
, pp. 1903
-
-
Victor, A.C.1
-
53
-
-
33744596259
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.28.1809
-
D. C. Langreth and M. J. Mehl, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.28.1809 28, 1809 (1983).
-
(1983)
Phys. Rev. B
, vol.28
, pp. 1809
-
-
Langreth, D.C.1
Mehl, M.J.2
-
54
-
-
0001520710
-
-
ACCRA9 0365-110X 10.1107/S0365110X52001064
-
R. S. Peace, Acta Crystallogr. ACCRA9 0365-110X 10.1107/S0365110X52001064 5, 356 (1952).
-
(1952)
Acta Crystallogr.
, vol.5
, pp. 356
-
-
Peace, R.S.1
-
55
-
-
36149028236
-
-
PHRVAO 0031-899X 10.1103/PhysRev.100.544
-
Y. Baskin and L. Meyer, Phys. Rev. PHRVAO 0031-899X 10.1103/PhysRev.100. 544 100, 544 (1955).
-
(1955)
Phys. Rev.
, vol.100
, pp. 544
-
-
Baskin, Y.1
Meyer, L.2
-
56
-
-
0000521551
-
-
JCPSA6 0021-9606 10.1063/1.1743030
-
L. A. Girifalco and R. A. Lad, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1743030 25, 693 (1956).
-
(1956)
J. Chem. Phys.
, vol.25
, pp. 693
-
-
Girifalco, L.A.1
Lad, R.A.2
-
57
-
-
42749102313
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.69.155406
-
R. Zacharia, H. Ulbricht, and T. Hertel, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.69.155406 69, 155406 (2004).
-
(2004)
Phys. Rev. B
, vol.69
, pp. 155406
-
-
Zacharia, R.1
Ulbricht, H.2
Hertel, T.3
-
58
-
-
0016092529
-
-
JAPIAU 0021-8979 10.1063/1.1663777
-
W. B. Gauster and I. J. Fritz, J. Appl. Phys. JAPIAU 0021-8979 10.1063/1.1663777 45, 3309 (1974).
-
(1974)
J. Appl. Phys.
, vol.45
, pp. 3309
-
-
Gauster, W.B.1
Fritz, I.J.2
-
60
-
-
0032540059
-
-
CHPLBC 0009-2614 10.1016/S0009-2614(97)01466-8
-
L. X. Benedict, N. G. Chopra, M. L. Cohen, A. Zettl, S. G. Louie, and V. H. Crespi, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/S0009-2614(97)01466-8 286, 490 (1998).
-
(1998)
Chem. Phys. Lett.
, vol.286
, pp. 490
-
-
Benedict, L.X.1
Chopra, N.G.2
Cohen, M.L.3
Zettl, A.4
Louie, S.G.5
Crespi, V.H.6
-
61
-
-
0001549098
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.58.13167
-
G. Kern and J. Hafner, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.58. 13167 58, 13167 (1998).
-
(1998)
Phys. Rev. B
, vol.58
, pp. 13167
-
-
Kern, G.1
Hafner, J.2
-
63
-
-
12944252320
-
-
SUSCAS 0039-6028 10.1016/S0039-6028(03)00109-2
-
H. Rydberg, N. Jacobson, P. Hyldgaard, S. I. Simak, B. I. Lundqvist, and D. C. Langreth, Surf. Sci. SUSCAS 0039-6028 10.1016/S0039-6028(03)00109-2 532, 606 (2003).
-
(2003)
Surf. Sci.
, vol.532
, pp. 606
-
-
Rydberg, H.1
Jacobson, N.2
Hyldgaard, P.3
Simak, S.I.4
Lundqvist, B.I.5
Langreth, D.C.6
-
64
-
-
0001113635
-
-
PRBMDO 0163-1829 10.1103/PhysRevB.60.7905
-
K. Rościszewski, B. Paulus, P. Fulde, and H. Stoll, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.60.7905 60, 7905 (1999).
-
(1999)
Phys. Rev. B
, vol.60
, pp. 7905
-
-
Rościszewski, K.1
Paulus, B.2
Fulde, P.3
Stoll, H.4
-
67
-
-
0037042667
-
-
JCPSA6 0021-9606 10.1063/1.1476010
-
T. van Mourik and R. J. Gdanitz, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1476010 116, 9620 (2002).
-
(2002)
J. Chem. Phys.
, vol.116
, pp. 9620
-
-
Van Mourik, T.1
Gdanitz, R.J.2
-
68
-
-
0002264731
-
-
CHPLBC 0009-2614 10.1016/S0009-2614(01)01088-0
-
R. J. Gdanitz, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/S0009-2614(01) 01088-0 348, 67 (2001).
-
(2001)
Chem. Phys. Lett.
, vol.348
, pp. 67
-
-
Gdanitz, R.J.1
-
69
-
-
0038205458
-
-
JCPSA6 0021-9606 10.1063/1.1566944
-
A. Wüest and F. Merkt, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1566944 118, 8807 (2003).
-
(2003)
J. Chem. Phys.
, vol.118
, pp. 8807
-
-
Wüest, A.1
Merkt, F.2
-
70
-
-
0042206845
-
-
JCPSA6 0021-9606 10.1063/1.1582838
-
P. Slavíček, R. Kalus, P. Paška, I. Odvárková, P. Hobza, and A. Malijevsý, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1582838 119, 2102 (2003).
-
(2003)
J. Chem. Phys.
, vol.119
, pp. 2102
-
-
Slavíček, P.1
Kalus, R.2
Paška, P.3
Odvá rková, I.4
Hobza, P.5
Malijevsý, A.6
-
72
-
-
0037043365
-
-
JCPSA6 0021-9606 10.1063/1.1482696
-
V. Aquilanti, M Bartolomei, D. Cappelletti, E. Carmona-Novillo, and F. Pirani, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1482696 117, 615 (2002).
-
(2002)
J. Chem. Phys.
, vol.117
, pp. 615
-
-
Aquilanti, V.1
Bartolomei, M.2
Cappelletti, D.3
Carmona-Novillo, E.4
Pirani, F.5
-
74
-
-
0003100270
-
-
CHPLBC 0009-2614 10.1016/S0009-2614(99)00431-5
-
O. Couronne and Y. Ellinger, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/S0009-2614(99)00431-5 306, 71 (1999).
-
(1999)
Chem. Phys. Lett.
, vol.306
, pp. 71
-
-
Couronne, O.1
Ellinger, Y.2
-
75
-
-
0000983578
-
-
CMPHC2 0301-0104 10.1016/S0301-0104(98)00287-0
-
C. A. Long, G. Henderson, and G. E. Ewing, Chem. Phys. CMPHC2 0301-0104 10.1016/S0301-0104(98)00287-0 2, 485 (1973).
-
(1973)
Chem. Phys.
, vol.2
, pp. 485
-
-
Long, C.A.1
Henderson, G.2
Ewing, G.E.3
-
76
-
-
0037045235
-
-
JACSAT 0002-7863 10.1021/ja0105212
-
S. Tsuzuki, K. Honda, T. Uchimaru, M. Mikami, and K. Tanabe, J. Am. Chem. Soc. JACSAT 0002-7863 10.1021/ja0105212 124, 104 (2002).
-
(2002)
J. Am. Chem. Soc.
, vol.124
, pp. 104
-
-
Tsuzuki, S.1
Honda, K.2
Uchimaru, T.3
Mikami, M.4
Tanabe, K.5
-
78
-
-
13844271589
-
-
PPCPFQ 1463-9076 10.1039/b415563g
-
T. R. Walsh, Phys. Chem. Chem. Phys. PPCPFQ 1463-9076 10.1039/b415563g 7, 443 (2005).
-
(2005)
Phys. Chem. Chem. Phys.
, vol.7
, pp. 443
-
-
Walsh, T.R.1
-
79
-
-
25144457993
-
-
JCPSA6 0021-9606 10.1063/1.2011396
-
T. Sato, T. Tsuneda, and K. Hirao, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.2011396 123, 104307 (2005).
-
(2005)
J. Chem. Phys.
, vol.123
, pp. 104307
-
-
Sato, T.1
Tsuneda, T.2
Hirao, K.3
-
81
-
-
0010785963
-
-
JCPSA6 0021-9606 10.1063/1.465035
-
E. Arunan and H. S. Gutowsky, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.465035 98, 4294 (1993).
-
(1993)
J. Chem. Phys.
, vol.98
, pp. 4294
-
-
Arunan, E.1
Gutowsky, H.S.2
-
82
-
-
10844235866
-
-
JCPSA6 0021-9606 10.1063/1.472649
-
E. J. Meijer and M. Sprik, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.472649 105, 8684 (1996).
-
(1996)
J. Chem. Phys.
, vol.105
, pp. 8684
-
-
Meijer, E.J.1
Sprik, M.2
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