-
1
-
-
0004154109
-
-
edited by J. Jortner and B. Pullman (Kluwer Academic, Dordrecht, Netherlands).
-
Perspectives in Photosynthesis, edited by, J. Jortner, and, B. Pullman, (Kluwer Academic, Dordrecht, Netherlands, 1990).
-
(1990)
Perspectives in Photosynthesis
-
-
-
2
-
-
0001155064
-
-
0066-426X,. 10.1146/annurev.pc.43.100192.003443
-
C. A. Mirkin and M. A. Ratner, Annu. Rev. Phys. Chem. 0066-426X 43, 719 (1992). 10.1146/annurev.pc.43.100192.003443
-
(1992)
Annu. Rev. Phys. Chem.
, vol.43
, pp. 719
-
-
Mirkin, C.A.1
Ratner, M.A.2
-
3
-
-
44349175026
-
-
10.1134/S1070363208040373 1070-3632
-
I. V. Dorogan, Russ. J. Gen. Chem. 78, 774 (2008). 10.1134/ S1070363208040373 1070-3632
-
(2008)
Russ. J. Gen. Chem.
, vol.78
, pp. 774
-
-
Dorogan, I.V.1
-
4
-
-
41949111772
-
Benchmarks for electronically excited states: CASPT2, CC2, CCSD, and CC3
-
DOI 10.1063/1.2889385
-
M. Schreiber, M. R. Silva-Junior, S. P. A. Sauer, and W. Thiel, J. Chem. Phys. 0021-9606 128, 134110 (2008). 10.1063/1.2889385 (Pubitemid 351506424)
-
(2008)
Journal of Chemical Physics
, vol.128
, Issue.13
, pp. 134110
-
-
Schreiber, M.1
Silva-Junior, M.R.2
Sauer, S.P.A.3
Thiel, W.4
-
5
-
-
28544448728
-
Single-reference ab initio methods for the calculation of excited states of large molecules
-
DOI 10.1021/cr0505627
-
A. Dreuw and M. Head-Gordon, Chem. Rev. (Washington, D.C.) 0009-2665 105, 4009 (2005). 10.1021/cr0505627 (Pubitemid 41741652)
-
(2005)
Chemical Reviews
, vol.105
, Issue.11
, pp. 4009-4037
-
-
Dreuw, A.1
Head-Gordon, M.2
-
6
-
-
45749092976
-
-
0001-4842,. 10.1021/ar7002144
-
V. Barone, R. Improta, and N. Rega, Acc. Chem. Res. 0001-4842 41, 605 (2008). 10.1021/ar7002144
-
(2008)
Acc. Chem. Res.
, vol.41
, pp. 605
-
-
Barone, V.1
Improta, R.2
Rega, N.3
-
7
-
-
33644973569
-
-
0001-4842,. 10.1021/ar0402006
-
A. I. Krylov, Acc. Chem. Res. 0001-4842 39, 83 (2006). 10.1021/ar0402006
-
(2006)
Acc. Chem. Res.
, vol.39
, pp. 83
-
-
Krylov, A.I.1
-
8
-
-
33846400493
-
High-order electron-correlation methods with scalar relativistic and spin-orbit corrections
-
DOI 10.1063/1.2423005
-
S. Hirata, T. Yanai, R. J. Harrison, M. Kamiya, and P. -D. Fan, J. Chem. Phys. 0021-9606 126, 024104 (2007). 10.1063/1.2423005 (Pubitemid 46127250)
-
(2007)
Journal of Chemical Physics
, vol.126
, Issue.2
, pp. 024104
-
-
Hirata, S.1
Yanai, T.2
Harrison, R.J.3
Kamiya, M.4
Fan, P.-D.5
-
9
-
-
68949119473
-
-
1050-2947,. 10.1103/PhysRevA.80.022507
-
G. Gidofalvi and D. A. Mazziotti, Phys. Rev. A 1050-2947 80, 022507 (2009). 10.1103/PhysRevA.80.022507
-
(2009)
Phys. Rev. A
, vol.80
, pp. 022507
-
-
Gidofalvi, G.1
Mazziotti, D.A.2
-
11
-
-
33847311807
-
Tracing ultrafast interatomic electronic decay processes in real time and space
-
DOI 10.1103/PhysRevLett.98.083201
-
A. I. Kuleff and L. S. Cederbaum, Phys. Rev. Lett. 0031-9007 98, 083201 (2007). 10.1103/PhysRevLett.98.083201 (Pubitemid 46326110)
-
(2007)
Physical Review Letters
, vol.98
, Issue.8
, pp. 083201
-
-
Kuleff, A.I.1
Cederbaum, L.S.2
-
12
-
-
17444399650
-
The multiconfiguration time-dependent Hartree-Fock method for quantum chemical calculations
-
DOI 10.1063/1.1862243, 124102
-
M. Nest, T. Klamroth, and P. Saalfrank, J. Chem. Phys. 0021-9606 122, 124102 (2005). 10.1063/1.1862243 (Pubitemid 40537447)
-
(2005)
Journal of Chemical Physics
, vol.122
, Issue.12
, pp. 1-7
-
-
Nest, M.1
Klamroth, T.2
Saalfrank, P.3
-
13
-
-
65649136207
-
-
1463-9076,. 10.1039/b817873a
-
S. Klinkusch, T. Klamroth, and P. Saalfrank, Phys. Chem. Chem. Phys. 1463-9076 11, 3875 (2009). 10.1039/b817873a
-
(2009)
Phys. Chem. Chem. Phys.
, vol.11
, pp. 3875
-
-
Klinkusch, S.1
Klamroth, T.2
Saalfrank, P.3
-
15
-
-
0347526901
-
-
0956-5000,. 10.1039/ft9908601741
-
G. G. Balint-Kurti, R. N. Dixon, and C. C. Marston, J. Chem. Soc., Faraday Trans. 0956-5000 86, 1741 (1990). 10.1039/ft9908601741
-
(1990)
J. Chem. Soc., Faraday Trans.
, vol.86
, pp. 1741
-
-
Balint-Kurti, G.G.1
Dixon, R.N.2
Marston, C.C.3
-
17
-
-
0042881198
-
-
0021-9606,. 10.1063/1.1590951
-
A. Dreuw, J. L. Weisman, and M. Head-Gordon, J. Chem. Phys. 0021-9606 119, 2943 (2003). 10.1063/1.1590951
-
(2003)
J. Chem. Phys.
, vol.119
, pp. 2943
-
-
Dreuw, A.1
Weisman, J.L.2
Head-Gordon, M.3
-
20
-
-
51749120716
-
-
in, edited by P. von Ragú Schleyer, N. L. Allinger, T. Clark, J. Gasteiger, P. Kollmann, H. F. Schaefer III, and P. R. Schreiner (Wiley, New York),.
-
L. S. Cederbaum, in Encyclopedia of Computational Chemistry, edited by, P. von Ragú Schleyer, N. L. Allinger, T. Clark, J. Gasteiger, P. Kollmann, H. F. Schaefer III, and, P. R. Schreiner, (Wiley, New York, 1998), p. 1202.
-
(1998)
Encyclopedia of Computational Chemistry
, pp. 1202
-
-
Cederbaum, L.S.1
-
21
-
-
0000815132
-
-
1050-2947,. 10.1103/PhysRevA.43.4647
-
J. Schirmer, Phys. Rev. A 1050-2947 43, 4647 (1991). 10.1103/PhysRevA.43. 4647
-
(1991)
Phys. Rev. A
, vol.43
, pp. 4647
-
-
Schirmer, J.1
-
22
-
-
0000741029
-
-
1050-2947,. 10.1103/PhysRevA.26.2395
-
J. Schirmer, Phys. Rev. A 1050-2947 26, 2395 (1982). 10.1103/PhysRevA.26. 2395
-
(1982)
Phys. Rev. A
, vol.26
, pp. 2395
-
-
Schirmer, J.1
-
23
-
-
35949017553
-
-
1050-2947,. 10.1103/PhysRevA.28.1237
-
J. Schirmer, L. S. Cederbaum, and O. Walter, Phys. Rev. A 1050-2947 28, 1237 (1983). 10.1103/PhysRevA.28.1237
-
(1983)
Phys. Rev. A
, vol.28
, pp. 1237
-
-
Schirmer, J.1
Cederbaum, L.S.2
Walter, O.3
-
24
-
-
0000526970
-
-
0020-7608,. 10.1002/(SICI)1097-461X(1996)58:4<329::AID-QUA23.0.CO;2-#
-
J. Schirmer and F. Mertins, Int. J. Quantum Chem. 0020-7608 58, 329 (1996). 10.1002/(SICI)1097-461X(1996)58:4<329::AID-QUA23.0.CO;2-#
-
(1996)
Int. J. Quantum Chem.
, vol.58
, pp. 329
-
-
Schirmer, J.1
Mertins, F.2
-
25
-
-
24244464915
-
-
0031-9007,. 10.1103/PhysRevLett.3.96
-
J. S. Bell and E. J. Squires, Phys. Rev. Lett. 0031-9007 3, 96 (1959). 10.1103/PhysRevLett.3.96
-
(1959)
Phys. Rev. Lett.
, vol.3
, pp. 96
-
-
Bell, J.S.1
Squires, E.J.2
-
26
-
-
0035430119
-
Optical potentials and propagators for elastic and inelastic scattering from many-body targets
-
DOI 10.1006/aphy.2001.6157, PII S0003491601961573
-
L. S. Cederbaum, Ann. Phys. 0003-3804 291, 169 (2001). 10.1006/aphy.2001.6157 (Pubitemid 33396458)
-
(2001)
Annals of Physics
, vol.291
, Issue.2
, pp. 169-201
-
-
Cederbaum, L.S.1
-
27
-
-
0029368062
-
-
0022-3654,. 10.1021/j100039a012
-
M. Head-Gordon, A. M. Grana, D. Maurice, and C. A. White, J. Phys. Chem. 0022-3654 99, 14261 (1995). 10.1021/j100039a012
-
(1995)
J. Phys. Chem.
, vol.99
, pp. 14261
-
-
Head-Gordon, M.1
Grana, A.M.2
Maurice, D.3
White, C.A.4
-
28
-
-
0000929755
-
-
1050-2947,. 10.1103/PhysRevA.39.1639
-
A. Tarantelli and L. S. Cederbaum, Phys. Rev. A 1050-2947 39, 1639 (1989). 10.1103/PhysRevA.39.1639
-
(1989)
Phys. Rev. A
, vol.39
, pp. 1639
-
-
Tarantelli, A.1
Cederbaum, L.S.2
-
29
-
-
0001505063
-
-
1050-2947,. 10.1103/PhysRevA.45.2790
-
A. Tarantelli and L. S. Cederbaum, Phys. Rev. A 1050-2947 45, 2790 (1992). 10.1103/PhysRevA.45.2790
-
(1992)
Phys. Rev. A
, vol.45
, pp. 2790
-
-
Tarantelli, A.1
Cederbaum, L.S.2
-
30
-
-
0009983859
-
-
1050-2947,. 10.1103/PhysRevA.49.3407
-
A. Tarantelli and L. S. Cederbaum, Phys. Rev. A 1050-2947 49, 3407 (1994). 10.1103/PhysRevA.49.3407
-
(1994)
Phys. Rev. A
, vol.49
, pp. 3407
-
-
Tarantelli, A.1
Cederbaum, L.S.2
-
31
-
-
34247397080
-
-
0953-4075,. 10.1088/0953-4075/28/12/003
-
A. B. Trofimov and J. Schirmer, J. Phys. B 0953-4075 28, 2299 (1995). 10.1088/0953-4075/28/12/003
-
(1995)
J. Phys. B
, vol.28
, pp. 2299
-
-
Trofimov, A.B.1
Schirmer, J.2
-
32
-
-
0000633144
-
-
1050-2947,. 10.1103/PhysRevA.53.2140
-
F. Mertins and J. Schirmer, Phys. Rev. A 1050-2947 53, 2140 (1996). 10.1103/PhysRevA.53.2140
-
(1996)
Phys. Rev. A
, vol.53
, pp. 2140
-
-
Mertins, F.1
Schirmer, J.2
-
33
-
-
0000829865
-
-
1050-2947,. 10.1103/PhysRevA.53.2153
-
F. Mertins, J. Schirmer, and A. Tarantelli, Phys. Rev. A 1050-2947 53, 2153 (1996). 10.1103/PhysRevA.53.2153
-
(1996)
Phys. Rev. A
, vol.53
, pp. 2153
-
-
Mertins, F.1
Schirmer, J.2
Tarantelli, A.3
-
34
-
-
0007760661
-
A non-Dyson third-order approximation scheme for the electron propagator
-
DOI 10.1063/1.477085, PII S0021960698306364
-
J. Schirmer, A. B. Trofimov, and G. Stelter, J. Chem. Phys. 0021-9606 109, 4734 (1998). 10.1063/1.477085 (Pubitemid 128672123)
-
(1998)
Journal of Chemical Physics
, vol.109
, Issue.12
, pp. 4734-4744
-
-
Schirmer, J.1
Trofimov, A.B.2
Stelter, G.3
-
35
-
-
77949261624
-
-
1432-881X,. 10.1007/s00214-009-0597-x
-
J. Schirmer and F. Mertins, Theor. Chem. Acc. 1432-881X 125, 145 (2010). 10.1007/s00214-009-0597-x
-
(2010)
Theor. Chem. Acc.
, vol.125
, pp. 145
-
-
Schirmer, J.1
Mertins, F.2
-
36
-
-
84987133683
-
-
0020-7608,. 10.1002/qua.560150204
-
E. Dalgaard, Int. J. Quantum Chem. 0020-7608 15, 169 (1979). 10.1002/qua.560150204
-
(1979)
Int. J. Quantum Chem.
, vol.15
, pp. 169
-
-
Dalgaard, E.1
-
37
-
-
28144454931
-
-
0021-9991,. 10.1016/0021-9991(91)90137-A
-
C. Leforestier, R. H. Bisseling, C. Cerjan, M. D. Feit, R. Friesner, A. Guldberg, A. Hammerich, G. Jolicard, W. Karrlein, H. -D. Meyer, N. Lipkin, O. Roncero, and R. Kosloff, J. Comput. Phys. 0021-9991 94, 59 (1991). 10.1016/0021-9991(91)90137-A
-
(1991)
J. Comput. Phys.
, vol.94
, pp. 59
-
-
Leforestier, C.1
Bisseling, R.H.2
Cerjan, C.3
Feit, M.D.4
Friesner, R.5
Guldberg, A.6
Hammerich, A.7
Jolicard, G.8
Karrlein, W.9
Meyer, H.-D.10
Lipkin, N.11
Roncero, O.12
Kosloff, R.13
-
38
-
-
33746563448
-
-
1463-9076,. 10.1039/b517914a
-
Y. Shao, L. F. Molnar, Y. Jung, J. Kussmann, C. Ochsenfeld, S. T. Brown, A. T. B. Gilbert, L. V. Slipchenko, S. V. Levchenko, D. P. O'Neill, R. A. DiStasio, Jr., R. C. Lochan, T. Wang, G. J. O. Beran, N. A. Besley, J. M. Herbert, C. Y. Lin, T. Van Voorhis, S. H. Chien, A. Sodt, R. P. Steele, V. A. Rassolov, P. E. Maslen, P. P. Korambath, R. D. Adamson, B. Austin, J. Baker, E. F. C. Byrd, H. Dachsel, R. J. Doerksen, A. Dreuw, B. D. Dunietz, A. D. Dutoi, T. R. Furlani, S. R. Gwaltney, A. Heyden, S. Hirata, C. -P. Hsu, G. Kedziora, R. Z. Khalliulin, P. Klunzinger, A. M. Lee, M. S. Lee, W. Liang, I. Lotan, N. Nair, B. Peters, E. I. Proynov, P. A. Pieniazek, Y. M. Rhee, J. Ritchie, E. Rosta, C. D. Sherrill, A. C. Simmonett, J. E. Subotnik, H. L. Woodcock III, W. Zhang, A. T. Bell, A. K. Chakraborty, D. M. Chipman, F. J. Keil, A. Warshel, W. J. Hehre, H. F. Schaefer III, J. Kong, A. I. Krylov, P. M. W. Gill, and M. Head-Gordon, Phys. Chem. Chem. Phys. 1463-9076 8, 3172 (2006). 10.1039/b517914a
-
(2006)
Phys. Chem. Chem. Phys.
, vol.8
, pp. 3172
-
-
Shao, Y.1
Molnar, L.F.2
Jung, Y.3
Kussmann, J.4
Ochsenfeld, C.5
Brown, S.T.6
Gilbert, A.T.B.7
Slipchenko, L.V.8
Levchenko, S.V.9
O'Neill, D.P.10
Distasio Jr., R.A.11
Lochan, R.C.12
Wang, T.13
Beran, G.J.O.14
Besley, N.A.15
Herbert, J.M.16
Lin, C.Y.17
Van Voorhis, T.18
Chien, S.H.19
Sodt, A.20
Steele, R.P.21
Rassolov, V.A.22
Maslen, P.E.23
Korambath, P.P.24
Adamson, R.D.25
Austin, B.26
Baker, J.27
Byrd, E.F.C.28
Dachsel, H.29
Doerksen, R.J.30
Dreuw, A.31
Dunietz, B.D.32
Dutoi, A.D.33
Furlani, T.R.34
Gwaltney, S.R.35
Heyden, A.36
Hirata, S.37
Hsu, C.-P.38
Kedziora, G.39
Khalliulin, R.Z.40
Klunzinger, P.41
Lee, A.M.42
Lee, M.S.43
Liang, W.44
Lotan, I.45
Nair, N.46
Peters, B.47
Proynov, E.I.48
Pieniazek, P.A.49
Rhee, Y.M.50
Ritchie, J.51
Rosta, E.52
Sherrill, C.D.53
Simmonett, A.C.54
Subotnik, J.E.55
Iii W. L, H.56
Zhang, W.57
Bell, A.T.58
Chakraborty, A.K.59
Chipman, D.M.60
Keil, F.J.61
Warshel, A.62
Hehre, W.J.63
Iii S. F, H.64
Kong, J.65
Krylov, A.I.66
Gill, P.M.W.67
Head-Gordon, M.68
more..
-
39
-
-
84983481443
-
-
0021-9606,. 10.1063/1.471429
-
H. -G. Weikert, H. -D. Meyer, and L. S. Cederbaum, J. Chem. Phys. 0021-9606 104, 7122 (1996). 10.1063/1.471429
-
(1996)
J. Chem. Phys.
, vol.104
, pp. 7122
-
-
Weikert, H.-G.1
Meyer, H.-D.2
Cederbaum, L.S.3
-
41
-
-
0000844583
-
-
0953-4075,. 10.1088/0953-4075/22/14/007
-
K. Kaufmann, W. Baumeister, and M. Jungen, J. Phys. B 0953-4075 22, 2223 (1989). 10.1088/0953-4075/22/14/007
-
(1989)
J. Phys. B
, vol.22
, pp. 2223
-
-
Kaufmann, K.1
Baumeister, W.2
Jungen, M.3
-
42
-
-
22544440608
-
Observation of resonant Interatomic Coulombic Decay in Ne clusters
-
DOI 10.1063/1.1937395, 241102
-
S. Barth, S. Joshi, S. Marburger, V. Ulrich, A. Lindblad, G. Öhrwall, O. Björneholm, and U. Hergenhahn, J. Chem. Phys. 0021-9606 122, 241102 (2005). 10.1063/1.1937395 (Pubitemid 41012613)
-
(2005)
Journal of Chemical Physics
, vol.122
, Issue.24
, pp. 1-4
-
-
Barth, S.1
Joshi, S.2
Marburger, S.3
Ulrich, V.4
Lindblad, A.5
Ohrwall, G.6
Bjorneholm, O.7
Hergenhahn, U.8
|