-
1
-
-
0000076750
-
The wavelength dependence of photoinduced hot electron dissociative attachment to methyl bromide adsorbed on gallium arsenide (110)
-
DOI 10.1063/1.476970, PII S0021960698707421
-
N. Camillone III, K. Khan, P. J. Lasky, L. Wu, J. E. Moryl, and R. M. Osgood Jr., J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.476970 109, 8045 (1998). (Pubitemid 128678378)
-
(1998)
Journal of Chemical Physics
, vol.109
, Issue.18
, pp. 8045-8057
-
-
Camillone, N.1
Khan, K.A.2
Lasky, P.J.3
Wu, L.4
Moryl, J.E.5
Osgood Jr., R.M.6
-
2
-
-
0033551901
-
Phonon- versus electron-mediated desorption and oxidation of CO on Ru(0001)
-
DOI 10.1126/science.285.5430.1042
-
M. Bonn, S. Funk, C. Hess, D. N. Denzler, C. Stampfl, M. Scheffler, M. Wolf, and G. Ertl, Science SCIEAS 0036-8075 10.1126/science.285.5430.1042 285, 1042 (1999). (Pubitemid 29385949)
-
(1999)
Science
, vol.285
, Issue.5430
, pp. 1042-1045
-
-
Bonn, M.1
Funk, S.2
Hess, Ch.3
Denzler, D.N.4
Stampfl, C.5
Scheffler, M.6
Wolf, M.7
Ertl, G.8
-
3
-
-
0033539072
-
Light-driven monodirectional molecular rotor
-
DOI 10.1038/43646
-
N. Koumura, R. W. Zijlstra, R. A. van Delden, and B. L. Harada, N. Freinga, Nature (London) NATUAS 0028-0836 10.1038/43646 401, 152 (1999). (Pubitemid 29436315)
-
(1999)
Nature
, vol.401
, Issue.6749
, pp. 152-155
-
-
Koumura, N.1
Zijistra, R.W.J.2
Van Delden, R.A.3
Harada, N.4
Feringa, B.L.5
-
5
-
-
0000597091
-
-
ARPLAP 0066-426X 10.1146/annurev.physchem.51.1.153
-
J. C. Tully, Annu. Rev. Phys. Chem. ARPLAP 0066-426X 10.1146/annurev. physchem.51.1.153 51, 153 (2000).
-
(2000)
Annu. Rev. Phys. Chem.
, vol.51
, pp. 153
-
-
Tully, J.C.1
-
7
-
-
0346058239
-
-
PRLTAO 0031-9007 10.1103/PhysRevLett.91.226102
-
D. Denzler, C. Frischkorn, C. Hess, M. Wolf, and G. Ertl, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.91.226102 91, 226102 (2003).
-
(2003)
Phys. Rev. Lett.
, vol.91
, pp. 226102
-
-
Denzler, D.1
Frischkorn, C.2
Hess, C.3
Wolf, M.4
Ertl, G.5
-
9
-
-
2342632618
-
-
JPCBFK 1520-6106 10.1021/jp036437l
-
K. Hoki, M. Yamaki, R. Sahnoun, L. González, S. Keseci, and Y. Fujimura, J. Phys. Chem. B JPCBFK 1520-6106 10.1021/jp036437l 108, 4916 (2004).
-
(2004)
J. Phys. Chem. B
, vol.108
, pp. 4916
-
-
Hoki, K.1
Yamaki, M.2
Sahnoun, R.3
González, L.4
Keseci, S.5
Fujimura, Y.6
-
10
-
-
4944237011
-
-
JPCBFK 1520-6106 10.1021/jp049199i
-
D. N. Denzler, C. Frischkorn, M. Wolf, and G. Ertl, J. Phys. Chem. B JPCBFK 1520-6106 10.1021/jp049199i 108, 14503 (2004).
-
(2004)
J. Phys. Chem. B
, vol.108
, pp. 14503
-
-
Denzler, D.N.1
Frischkorn, C.2
Wolf, M.3
Ertl, G.4
-
11
-
-
3442901066
-
Real-Space observation of molecular motion induced by femtosecond laser pulses
-
DOI 10.1126/science.1099770
-
L. Bartels, F. Wang, D. Möller, and T. Knoesel, E. Heinz, Science SCIEAS 0036-8075 10.1126/science.1099770 305, 648 (2004). (Pubitemid 39006748)
-
(2004)
Science
, vol.305
, Issue.5684
, pp. 648-651
-
-
Bartels, L.1
Wang, F.2
Moller, D.3
Knoesel, E.4
Heinz, T.F.5
-
12
-
-
27744560744
-
Time-resolved measurement of surface diffusion induced by femtosecond laser pulses
-
DOI 10.1103/PhysRevLett.94.236103, 236103
-
K. Stépan, J. Güdde, and U. Höffer, Phys. Rev. Lett. 0031-9007 10.1103/PhysRevLett.94.236103 94, 236103 (2005). (Pubitemid 41636563)
-
(2005)
Physical Review Letters
, vol.94
, Issue.23
, pp. 1-4
-
-
Stepan, K.1
Gudde, J.2
Hofer, U.3
-
13
-
-
33751310797
-
Quantum dynamical approach to ultrafast molecular desorption from surfaces
-
DOI 10.1021/cr0501691
-
P. Saalfrank, Chem. Rev. CHREAY 0009-2665 10.1021/cr0501691 106, 4116 (2006). (Pubitemid 44801203)
-
(2006)
Chemical Reviews
, vol.106
, Issue.10
, pp. 4116-4159
-
-
Saalfrank, P.1
-
14
-
-
0035935407
-
The dynamics of vibrational excitations on surfaces: CO on Ru(001)
-
DOI 10.1063/1.1404986
-
M. Bonn, C. Hess, and M. Wolf, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1404986 115, 7725 (2001). (Pubitemid 33050799)
-
(2001)
Journal of Chemical Physics
, vol.115
, Issue.16
, pp. 7725-7735
-
-
Bonn, M.1
Hess, C.2
Wolf, M.3
-
15
-
-
34548526397
-
-
CMPHC2 0301-0104 10.1016/j.chemphys.2007.04.022
-
T. Vazhappilly, S. Beyvers, T. Klamroth, M. Luppi, and P. Saalfrank, Chem. Phys. CMPHC2 0301-0104 10.1016/j.chemphys.2007.04.022 338, 299 (2007).
-
(2007)
Chem. Phys.
, vol.338
, pp. 299
-
-
Vazhappilly, T.1
Beyvers, S.2
Klamroth, T.3
Luppi, M.4
Saalfrank, P.5
-
16
-
-
67049136063
-
-
1932-7447 10.1021/jp810709k
-
T. Vazhappilly, T. Klamroth, P. Saalfrank, and R. Hernandez, J. Phys. Chem. C 1932-7447 10.1021/jp810709k 113, 7790 (2009).
-
(2009)
J. Phys. Chem. C
, vol.113
, pp. 7790
-
-
Vazhappilly, T.1
Klamroth, T.2
Saalfrank, P.3
Hernandez, R.4
-
17
-
-
77958564008
-
-
PPCPFQ 1463-9076 10.1039/c0cp00895h
-
G. Füchsel, T. Klamroth, J. C. Tremblay, and P. Saalfrank, Phys. Chem. Chem. Phys. PPCPFQ 1463-9076 10.1039/c0cp00895h 12, 14082 (2010).
-
(2010)
Phys. Chem. Chem. Phys.
, vol.12
, pp. 14082
-
-
Füchsel, G.1
Klamroth, T.2
Tremblay, J.C.3
Saalfrank, P.4
-
18
-
-
79955539352
-
-
PPCPFQ 1463-9076 10.1039/c0cp02086a
-
G. Füchsel, T. Klamroth, S. Monturet, and P. Saalfrank, Phys. Chem. Chem. Phys. PPCPFQ 1463-9076 10.1039/c0cp02086a 13, 8659 (2011).
-
(2011)
Phys. Chem. Chem. Phys.
, vol.13
, pp. 8659
-
-
Füchsel, G.1
Klamroth, T.2
Monturet, S.3
Saalfrank, P.4
-
20
-
-
69549108032
-
-
JCPSA6 0021-9606 10.1063/1.3212695
-
J. C. Tremblay and P. Saalfrank, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.3212695 131, 084716 (2009).
-
(2009)
J. Chem. Phys.
, vol.131
, pp. 084716
-
-
Tremblay, J.C.1
Saalfrank, P.2
-
21
-
-
0000562332
-
-
SCIEAS 0036-8075 10.1126/science.180.4085.451
-
V. S. Letokhov, Science SCIEAS 0036-8075 10.1126/science.180.4085.451 180, 451 (1973).
-
(1973)
Science
, vol.180
, pp. 451
-
-
Letokhov, V.S.1
-
22
-
-
0001526294
-
-
SCIEAS 0036-8075 10.1126/science.249.4975.1387
-
F. F. Crim, Science SCIEAS 0036-8075 10.1126/science.249.4975.1387 249, 1387 (1990).
-
(1990)
Science
, vol.249
, pp. 1387
-
-
Crim, F.F.1
-
23
-
-
36449002659
-
-
JCPSA6 0021-9606 10.1063/1.464655
-
M. Shapiro and P. Brumer, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.464655 98, 201 (1993).
-
(1993)
J. Chem. Phys.
, vol.98
, pp. 201
-
-
Shapiro, M.1
Brumer, P.2
-
24
-
-
33645681300
-
-
SCIEAS 0036-8075 10.1126/science.1123057
-
P. Nieto, E. Pijper, D. Barredo, G. Laurent, R. A. Olsen, E.-J. Baerends, G.-J. Kroes, and D. Farías, Science SCIEAS 0036-8075 10.1126/science.1123057 312, 86 (2006).
-
(2006)
Science
, vol.312
, pp. 86
-
-
Nieto, P.1
Pijper, E.2
Barredo, D.3
Laurent, G.4
Olsen, R.A.5
Baerends, E.-J.6
Kroes, G.-J.7
Farías, D.8
-
25
-
-
41449116791
-
Role of electron-hole pair excitations in the dissociative adsorption of diatomic molecules on metal surfaces
-
DOI 10.1103/PhysRevLett.100.116102
-
J. I. Juaristi, M. Alducin, R. Díez Muiño, H. F. Busnengo, and A. Salin, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.100.116102 100, 116102 (2008). (Pubitemid 351457218)
-
(2008)
Physical Review Letters
, vol.100
, Issue.11
, pp. 116102
-
-
Juaristi, J.I.1
Alducin, M.2
Muino, R.D.3
Busnengo, H.F.4
Salin, A.5
-
26
-
-
63249097883
-
-
PRLTAO 0031-9007 10.1103/PhysRevLett.102.109601
-
A. C. Luntz, I. Makkonen, M. Persson, S. Holloway, D. M. Bird, and M. S. Mizielinski, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.102.109601 102, 109601 (2009).
-
(2009)
Phys. Rev. Lett.
, vol.102
, pp. 109601
-
-
Luntz, A.C.1
Makkonen, I.2
Persson, M.3
Holloway, S.4
Bird, D.M.5
Mizielinski, M.S.6
-
27
-
-
63249102802
-
-
PRLTAO 0031-9007 10.1103/PhysRevLett.102.109602
-
J. I. Juaristi, M. Alducin, R. Díez Muiño, H. F. Busnengo, and A. Salin, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.102.109602 102, 109602 (2009).
-
(2009)
Phys. Rev. Lett.
, vol.102
, pp. 109602
-
-
Juaristi, J.I.1
Alducin, M.2
Díez Muiño, R.3
Busnengo, H.F.4
Salin, A.5
-
28
-
-
78650463008
-
-
PNASA6 0027-8424 10.1073/pnas.1001098107
-
G.-J. Kroes, C. Diaz, E. Pijpera, R. A. Olsena, and D. J. Auerbach, Publ. Natl. Acad. Sci. USA PNASA6 0027-8424 10.1073/pnas.1001098107 107, 20881 (2010).
-
(2010)
Publ. Natl. Acad. Sci. USA
, vol.107
, pp. 20881
-
-
Kroes, G.-J.1
Diaz, C.2
Pijpera, E.3
Olsena, R.A.4
Auerbach, D.J.5
-
29
-
-
36449000392
-
-
JCPSA6 0021-9606 10.1063/1.461896
-
M. Head-Gordon and J. C. Tully, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.461896 96, 3939 (1992).
-
(1992)
J. Chem. Phys.
, vol.96
, pp. 3939
-
-
Head-Gordon, M.1
Tully, J.C.2
-
31
-
-
2242440384
-
-
JCPSA6 0021-9606 10.1063/1.1675788
-
J. C. Tully and R. K. Preston, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1675788 55, 562 (1971).
-
(1971)
J. Chem. Phys.
, vol.55
, pp. 562
-
-
Tully, J.C.1
Preston, R.K.2
-
33
-
-
65549090095
-
-
JCPSA6 0021-9606 10.1063/1.3122989
-
S. Roy, N. A. Shenvi, and J. C. Tully, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.3122989 130, 174716 (2009).
-
(2009)
J. Chem. Phys.
, vol.130
, pp. 174716
-
-
Roy, S.1
Shenvi, N.A.2
Tully, J.C.3
-
34
-
-
77952709379
-
-
JCPSA6 0021-9606 10.1063/1.3424765
-
M. S. Mizielinski and D. M. Bird, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.3424765 132, 184704 (2010).
-
(2010)
J. Chem. Phys.
, vol.132
, pp. 184704
-
-
Mizielinski, M.S.1
Bird, D.M.2
-
35
-
-
79955424265
-
-
PPCPFQ 1463-9076 10.1039/c0cp01418d
-
D. Matsiev, Z. Li, R. Cooper, I. Rahinov, C. Bartels, D. J. Auerbach, and A. M. Wodtke, Phys. Chem. Chem. Phys. PPCPFQ 1463-9076 10.1039/c0cp01418d 13, 8153 (2011).
-
(2011)
Phys. Chem. Chem. Phys.
, vol.13
, pp. 8153
-
-
Matsiev, D.1
Li, Z.2
Cooper, R.3
Rahinov, I.4
Bartels, C.5
Auerbach, D.J.6
Wodtke, A.M.7
-
36
-
-
81355161285
-
-
2041-6520 10.1039/c1sc00181g
-
C. Bartels, R. Cooper, D. J. Auerbach, and A. M. Wodtke, Chem. Sci. 2041-6520 10.1039/c1sc00181g 2, 1647 (2011).
-
(2011)
Chem. Sci.
, vol.2
, pp. 1647
-
-
Bartels, C.1
Cooper, R.2
Auerbach, D.J.3
Wodtke, A.M.4
-
37
-
-
0000331323
-
-
PHSTBO 0031-8949 10.1088/0031-8949/29/4/014
-
B. Hellsing and M. Persson, Phys. Scr. PHSTBO 0031-8949 10.1088/0031-8949/29/4/014 29, 360 (1984).
-
(1984)
Phys. Scr.
, vol.29
, pp. 360
-
-
Hellsing, B.1
Persson, M.2
-
38
-
-
36149043175
-
-
JPSOAW 0022-3719 10.1088/0022-3719/17/26/020
-
B. N. J. Persson, J. Phys. C JPSOAW 0022-3719 10.1088/0022-3719/17/26/020 17, 4741 (1984).
-
(1984)
J. Phys. C
, vol.17
, pp. 4741
-
-
Persson, B.N.J.1
-
39
-
-
33746887743
-
Vibrational lifetimes of molecular adsorbates on metal surfaces
-
DOI 10.1063/1.2227383
-
V. Krishna and J. C. Tully, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.2227383 125, 054706 (2006). (Pubitemid 44188430)
-
(2006)
Journal of Chemical Physics
, vol.125
, Issue.5
, pp. 054706
-
-
Krishna, V.1
Tully, J.C.2
-
40
-
-
65649141578
-
-
PRBMDO 1098-0121 10.1103/PhysRevB.79.165407
-
M. Timmer and P. Kratzer, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.79.165407 79, 165407 (2009).
-
(2009)
Phys. Rev. B
, vol.79
, pp. 165407
-
-
Timmer, M.1
Kratzer, P.2
-
41
-
-
67650218202
-
-
JAPIAU 0021-8979 10.1063/1.3117236
-
M. Richter, A. Carmele, S. Butscher, N. Bücking, F. Milde, P. Kratzer, M. Scheffler, and A. Knorr, J. Appl. Phys. JAPIAU 0021-8979 10.1063/1.3117236 105, 122409 (2009).
-
(2009)
J. Appl. Phys.
, vol.105
, pp. 122409
-
-
Richter, M.1
Carmele, A.2
Butscher, S.3
Bücking, N.4
Milde, F.5
Kratzer, P.6
Scheffler, M.7
Knorr, A.8
-
42
-
-
0000982623
-
-
PRBMDO 1098-0121 10.1103/PhysRevB.27.6121
-
M. J. Puska and R. M. Nieminen, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.27.6121 27, 6121 (1983).
-
(1983)
Phys. Rev. B
, vol.27
, pp. 6121
-
-
Puska, M.J.1
Nieminen, R.M.2
-
43
-
-
0041527079
-
-
PRBMDO 1098-0121 10.1103/PhysRevB.67.245401
-
H. Winter, J. I. Juaristi, I. Nagy, A. Arnau, and P. M. Echenique, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.67.245401 67, 245401 (2003).
-
(2003)
Phys. Rev. B
, vol.67
, pp. 245401
-
-
Winter, H.1
Juaristi, J.I.2
Nagy, I.3
Arnau, A.4
Echenique, P.M.5
-
45
-
-
84861034435
-
-
ISJCAT 0021-2148 10.1002/ijch.201100097
-
G. Füchsel, J. C. Tremblay, T. Klamroth, and P. Saalfrank, Isr. J. Chem. ISJCAT 0021-2148 10.1002/ijch.201100097 52, 438 (2012).
-
(2012)
Isr. J. Chem.
, vol.52
, pp. 438
-
-
Füchsel, G.1
Tremblay, J.C.2
Klamroth, T.3
Saalfrank, P.4
-
47
-
-
0011451807
-
-
JCPSA6 0021-9606 10.1063/1.480494
-
A. Bahel and Z. Bačić, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.480494 111, 11164 (1999).
-
(1999)
J. Chem. Phys.
, vol.111
, pp. 11164
-
-
Bahel, A.1
Bačić, Z.2
-
50
-
-
10844241375
-
Multidimensional density operator propagations in open systems: Model studies on vibrational relaxations and surface sticking processes
-
DOI 10.1063/1.1807392
-
C. Cattarius and H.-D. Meyer, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1807392 121, 9283 (2004). (Pubitemid 40001693)
-
(2004)
Journal of Chemical Physics
, vol.121
, Issue.19
, pp. 9283-9296
-
-
Cattarius, C.1
Meyer, H.-D.2
-
52
-
-
33745300814
-
Optimal control in a dissipative system: Vibrational excitation of CO/Cu(100) by IR pulses
-
DOI 10.1063/1.2206593
-
S. Beyvers, Y. Ohtsuki, and P. Saalfrank, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.2206593 124, 234706 (2006). (Pubitemid 43938915)
-
(2006)
Journal of Chemical Physics
, vol.124
, Issue.23
, pp. 234706
-
-
Beyvers, S.1
Ohtsuki, Y.2
Saalfrank, P.3
-
53
-
-
44349177993
-
Selective excitation of coupled CO vibrations on a dissipative Cu(100) surface by shaped infrared laser pulses
-
DOI 10.1063/1.2916710
-
J. C. Tremblay, S. Beyvers, and P. Saalfrank, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.2916710 128, 194709 (2008). (Pubitemid 351733995)
-
(2008)
Journal of Chemical Physics
, vol.128
, Issue.19
, pp. 194709
-
-
Tremblay, J.C.1
Beyvers, S.2
Saalfrank, P.3
-
55
-
-
77149179386
-
-
JCPSA6 0021-9606 10.1063/1.3308481
-
R. Marquardt, F. Cuvelier, R. A. Olsen, E. J. Baerends, J. C. Tremblay, and P. Saalfrank, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.3308481 132, 074108 (2010).
-
(2010)
J. Chem. Phys.
, vol.132
, pp. 074108
-
-
Marquardt, R.1
Cuvelier, F.2
Olsen, R.A.3
Baerends, E.J.4
Tremblay, J.C.5
Saalfrank, P.6
-
56
-
-
34248209533
-
Breaking relaxing bonds at a H:Si(100)-(2 × 1) surface with infrared laser pulses
-
DOI 10.1021/jp067796u
-
G. K. Paramonov, I. Andrianov, and P. Saalfrank, J. Phys. Chem. C 1932-7447 10.1021/jp067796u 111, 5432 (2007). (Pubitemid 46723967)
-
(2007)
Journal of Physical Chemistry C
, vol.111
, Issue.14
, pp. 5432-5440
-
-
Paramonov, G.K.1
Andrianov, I.2
Saalfrank, P.3
-
57
-
-
26344461732
-
-
CMPHC2 0301-0104 10.1016/0301-0104(89)90012-8
-
R. Kosloff, S. A. Rice, P. Gaspard, S. Tersigni, and D. J. Tannor, Chem. Phys. CMPHC2 0301-0104 10.1016/0301-0104(89)90012-8 139, 201 (1989).
-
(1989)
Chem. Phys.
, vol.139
, pp. 201
-
-
Kosloff, R.1
Rice, S.A.2
Gaspard, P.3
Tersigni, S.4
Tannor, D.J.5
-
59
-
-
0028405171
-
-
JCPSA6 0021-9606 10.1063/1.467132
-
M. Sugawara and Y. Fujimara, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.467132 100, 5646 (1994).
-
(1994)
J. Chem. Phys.
, vol.100
, pp. 5646
-
-
Sugawara, M.1
Fujimara, Y.2
-
60
-
-
84864610112
-
-
in edited by A. J. Bandrauk (Dekker, New York
-
D. J. Tannor, in Molecule in Laser fields, edited by, A. J. Bandrauk, (Dekker, New York, 1992), p. 413.
-
(1992)
Molecule in Laser Fields
, pp. 413
-
-
Tannor, D.J.1
-
61
-
-
0032389496
-
Quantum control of nuclear wave packets by locally designed optimal pulses
-
DOI 10.1063/1.477593, PII S002196069800645X
-
Y. Ohtsuki, H. Kono, and Y. Fujimura, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.477593 109, 9318 (1998). (Pubitemid 128672515)
-
(1998)
Journal of Chemical Physics
, vol.109
, Issue.21
, pp. 9318-9331
-
-
Ohtsuki, Y.1
Kono, H.2
Fujimura, Y.3
-
62
-
-
0032495946
-
-
CHPLBC 0009-2614 10.1016/S0009-2614(98)00224-3
-
Y. Ohtsuki, Y. Yahata, H. Kono, and Y. Fujimura, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/S0009-2614(98)00224-3 287, 627 (1998).
-
(1998)
Chem. Phys. Lett.
, vol.287
, pp. 627
-
-
Ohtsuki, Y.1
Yahata, Y.2
Kono, H.3
Fujimura, Y.4
-
63
-
-
0342484442
-
-
JPCAFH 1089-5639 10.1021/jp000217f
-
Y. Zhao and O. Kühn, J. Phys. Chem. A JPCAFH 1089-5639 10.1021/jp000217f 104, 4882 (2000).
-
(2000)
J. Phys. Chem. A
, vol.104
, pp. 4882
-
-
Zhao, Y.1
Kühn, O.2
-
65
-
-
57449117700
-
-
PLRAAN 1050-2947 10.1103/PhysRevA.78.063408
-
J. C. Tremblay and P. Saalfrank, Phys. Rev. A PLRAAN 1050-2947 10.1103/PhysRevA.78.063408 78, 063408 (2008).
-
(2008)
Phys. Rev. A
, vol.78
, pp. 063408
-
-
Tremblay, J.C.1
Saalfrank, P.2
-
66
-
-
79957525138
-
-
JCPSA6 0021-9606 10.1063/1.3587093
-
J. C. Tremblay, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.3587093 134, 174111 (2011).
-
(2011)
J. Chem. Phys.
, vol.134
, pp. 174111
-
-
Tremblay, J.C.1
-
69
-
-
0011451109
-
-
CHPLBC 0009-2614 10.1016/0009-2614(90)80078-R
-
J. T. Muckerman, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/0009-2614(90) 80078-R 173, 200 (1990).
-
(1990)
Chem. Phys. Lett.
, vol.173
, pp. 200
-
-
Muckerman, J.T.1
-
70
-
-
0000042386
-
-
JCPSA6 0021-9606 10.1063/1.460317
-
C. Leforestier, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.460317 94, 6388 (1991).
-
(1991)
J. Chem. Phys.
, vol.94
, pp. 6388
-
-
Leforestier, C.1
-
71
-
-
0040532910
-
-
JCPSA6 0021-9606 10.1063/1.462100
-
D. T. Colbert and W. H. Miller, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.462100 96, 1982 (1992).
-
(1992)
J. Chem. Phys.
, vol.96
, pp. 1982
-
-
Colbert, D.T.1
Miller, W.H.2
-
72
-
-
0000291562
-
-
CHPLBC 0009-2614 10.1016/0009-2614(92)85330-D
-
J. Echave and D. C. Clary, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/0009-2614(92)85330-D 190, 225 (1992).
-
(1992)
Chem. Phys. Lett.
, vol.190
, pp. 225
-
-
Echave, J.1
Clary, D.C.2
-
73
-
-
12144262727
-
-
JCPSA6 0021-9606 10.1063/1.463044
-
H. Wei and T. Carrington Jr., J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.463044 97, 3029 (1992).
-
(1992)
J. Chem. Phys.
, vol.97
, pp. 3029
-
-
Wei, H.1
Carrington Jr., T.2
-
75
-
-
0000963539
-
-
JCPSA6 0021-9606 10.1063/1.473714
-
H. Wei, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.473714 106, 6885 (1997).
-
(1997)
J. Chem. Phys.
, vol.106
, pp. 6885
-
-
Wei, H.1
-
77
-
-
21244495652
-
A coherent discrete variable representation method for multidimensional systems in physics
-
DOI 10.1063/1.1884116, 164107
-
H.-G. Yu, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1884116 122, 164107 (2005). (Pubitemid 40890443)
-
(2005)
Journal of Chemical Physics
, vol.122
, Issue.16
, pp. 1-6
-
-
Yu, H.-G.1
-
78
-
-
33748558835
-
Calculating vibrational energies and wave functions of vinylidene using a contracted basis with a locally reorthogonalized coupled two-term Lanczos eigensolver
-
DOI 10.1063/1.2234480
-
J. C. Tremblay and T. Carrington Jr., J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.2234480 125, 094311 (2006). (Pubitemid 44370715)
-
(2006)
Journal of Chemical Physics
, vol.125
, Issue.9
, pp. 094311
-
-
Tremblay, J.C.1
Carrington Jr., T.2
-
80
-
-
0000228405
-
-
JCPSA6 0021-9606 10.1063/1.478001
-
H.-G. Yu and G. Nyman, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.478001 110, 11133 (1999).
-
(1999)
J. Chem. Phys.
, vol.110
, pp. 11133
-
-
Yu, H.-G.1
Nyman, G.2
-
82
-
-
0035826483
-
Using the symmetric quasiminimal residuals method to accelerate an inexact spectral transform calculation of energy levels and wave functions
-
DOI 10.1063/1.1356005
-
S.-W. Huang and T. Carrington Jr., J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1356005 114, 6485 (2001). (Pubitemid 32419625)
-
(2001)
Journal of Chemical Physics
, vol.114
, Issue.14
, pp. 6485-6486
-
-
Huang, S.-W.1
Carrington Jr., T.2
-
83
-
-
0035341870
-
Calculating interior eigenvalues and eigenvectors with an implicitly restarted and a filter diagonalization method
-
DOI 10.1016/S0168-9274(00)00046-5, PII S0168927400000465
-
S.-W. Huang and T. Carrington Jr., Appl. Numer. Math. ANMAEL 0168-9274 10.1016/S0168-9274(00)00046-5 37, 307 (2001). (Pubitemid 32272132)
-
(2001)
Applied Numerical Mathematics
, vol.37
, Issue.3
, pp. 307-317
-
-
Huang, S.-W.1
Carrington Jr., T.2
-
84
-
-
0001434078
-
-
PRLTAO 0031-9007 10.1103/PhysRevLett.65.480
-
C. J. Hirschmugl, G. P. Williams, F. M. Hofmann, and Y. J. Chabal, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.65.480 65, 480 (1990).
-
(1990)
Phys. Rev. Lett.
, vol.65
, pp. 480
-
-
Hirschmugl, C.J.1
Williams, G.P.2
Hofmann, F.M.3
Chabal, Y.J.4
-
85
-
-
0001504010
-
-
CHREAY 0009-2665 10.1021/cr9502209
-
F. Hofmann and J. P. Toennies, Chem. Rev. CHREAY 0009-2665 10.1021/cr9502209 96, 1307 (1996).
-
(1996)
Chem. Rev.
, vol.96
, pp. 1307
-
-
Hofmann, F.1
Toennies, J.P.2
-
86
-
-
0001240675
-
-
JCPSA6 0021-9606 10.1063/1.476219
-
A. P. Graham, F. Hofmann, J. P. Toennies, G. P. Williams, C. J. Hirschmugl, and J. Ellis, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.476219 108, 7825 (1998).
-
(1998)
J. Chem. Phys.
, vol.108
, pp. 7825
-
-
Graham, A.P.1
Hofmann, F.2
Toennies, J.P.3
Williams, G.P.4
Hirschmugl, C.J.5
Ellis, J.6
-
87
-
-
3543009193
-
-
CMPHAY 0010-3616 10.1007/BF01608499
-
G. Lindblad, Commun. Math. Phys. CMPHAY 0010-3616 10.1007/BF01608499 48, 119 (1976).
-
(1976)
Commun. Math. Phys.
, vol.48
, pp. 119
-
-
Lindblad, G.1
-
88
-
-
11044224957
-
Using preconditioned adaptive step size Runge-Kutta methods for solving the time-dependent Schrödinger equation
-
DOI 10.1063/1.1814103, 7
-
J. C. Tremblay and T. Carrington Jr., J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1814103 121, 11535 (2004). (Pubitemid 40044257)
-
(2004)
Journal of Chemical Physics
, vol.121
, Issue.23
, pp. 11535-11541
-
-
Tremblay, J.C.1
Carrington Jr., T.2
-
90
-
-
33645898818
-
-
PRBMDO 1098-0121 10.1103/PhysRevB.45.13244
-
J. P. Perdew and Y. Wang, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.45.13244 45, 13244 (1992).
-
(1992)
Phys. Rev. B
, vol.45
, pp. 13244
-
-
Perdew, J.P.1
Wang, Y.2
-
91
-
-
2442537377
-
-
PRBMDO 1098-0121 10.1103/PhysRevB.54.11169
-
G. Kresse and J. Furthmuller, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.54.11169 54, 11169 (1996).
-
(1996)
Phys. Rev. B
, vol.54
, pp. 11169
-
-
Kresse, G.1
Furthmuller, J.2
-
92
-
-
0030190741
-
Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set
-
DOI 10.1016/0927-0256(96)00008-0, PII S0927025696000080
-
G. Kresse and J. Furthmuller, Comput. Math. Sci. CMMSEM 0927-0256 10.1016/0927-0256(96)00008-0 6, 15 (1996). (Pubitemid 126412269)
-
(1996)
Computational Materials Science
, vol.6
, Issue.1
, pp. 15-50
-
-
Kresse, G.1
Furthmuller, J.2
-
93
-
-
1842816907
-
-
PRBMDO 1098-0121 10.1103/PhysRevB.13.5188
-
H. J. Monkhorst and J. D. Pack, Phys. Rev. B PRBMDO 1098-0121 10.1103/PhysRevB.13.5188 13, 5188 (1976).
-
(1976)
Phys. Rev. B
, vol.13
, pp. 5188
-
-
Monkhorst, H.J.1
Pack, J.D.2
-
94
-
-
3142771297
-
-
CHPLBC 0009-2614 10.1016/j.cplett.2004.06.011
-
T. Yanai, D. Tew, and N. Handy, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/j.cplett.2004.06.011 393, 51 (2004).
-
(2004)
Chem. Phys. Lett.
, vol.393
, pp. 51
-
-
Yanai, T.1
Tew, D.2
Handy, N.3
-
96
-
-
33745770836
-
-
JCPSA6 0021-9606 10.1063/1.448799
-
P. J. Hay and W. R. Wadt, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.448799 82, 270 (1985).
-
(1985)
J. Chem. Phys.
, vol.82
, pp. 270
-
-
Hay, P.J.1
Wadt, W.R.2
-
97
-
-
0006073669
-
-
JCPSA6 0021-9606 10.1063/1.448800
-
W. R. Wadt and P. J. Hay, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.448800 82, 284 (1985).
-
(1985)
J. Chem. Phys.
, vol.82
, pp. 284
-
-
Wadt, W.R.1
Hay, P.J.2
-
98
-
-
27344448074
-
-
JCPSA6 0021-9606 10.1063/1.448975
-
P. J. Hay and W. R. Wadt, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.448975 82, 299 (1985).
-
(1985)
J. Chem. Phys.
, vol.82
, pp. 299
-
-
Hay, P.J.1
Wadt, W.R.2
-
100
-
-
0001492139
-
-
JCPSA6 0021-9606 10.1063/1.466551
-
J. M. Ricart, A. Clotet, F. Illas, and J. Rubio, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.466551 100, 1988 (1994).
-
(1994)
J. Chem. Phys.
, vol.100
, pp. 1988
-
-
Ricart, J.M.1
Clotet, A.2
Illas, F.3
Rubio, J.4
|