-
1
-
-
0001039562
-
-
in, edited by D. R. Yarkony, (World Scientific, Singapore), Vol
-
R. J. Bartlett, in Modern Electronic Structure Theory, edited by, D. R. Yarkony, (World Scientific, Singapore, 1995), Vol. 1, pp. 1047-1131.
-
(1995)
Modern Electronic Structure Theory
, vol.1
, pp. 1047-1131
-
-
Bartlett, R.J.1
-
3
-
-
84855334530
-
-
in, edited by K. B. Lipkowitz and D. B. Boyd, (Wiley, New York), Vol
-
T. D. Crawford and H. F. Schaefer III, in Reviews of Computational Chemistry, edited by, K. B. Lipkowitz, and, D. B. Boyd, (Wiley, New York, 2000), Vol. 14, pp. 33-136.
-
(2000)
Reviews of Computational Chemistry
, vol.14
, pp. 33-136
-
-
Crawford, T.D.1
Schaefer III, H.F.2
-
4
-
-
0041992296
-
-
in, edited by S. Wilson (Wiley, Chichester), Vol., Part 3, Cha 19
-
J. Paldus, in Handbook of Molecular Physics and Quantum Chemistry, edited by, S. Wilson, (Wiley, Chichester, 2003), Vol. 2, Part 3, Chap. 19, pp. 272-313.
-
(2003)
Handbook of Molecular Physics and Quantum Chemistry
, vol.2
, pp. 272-313
-
-
Paldus, J.1
-
5
-
-
33847389465
-
Coupled-cluster theory in quantum chemistry
-
DOI 10.1103/RevModPhys.79.291
-
R. J. Bartlett and M. Musia, Rev. Mod. Phys. 79, 291 (2007). 10.1103/RevModPhys.79.291 (Pubitemid 46346056)
-
(2007)
Reviews of Modern Physics
, vol.79
, Issue.1
, pp. 291-352
-
-
Bartlett, R.J.1
Musial, M.2
-
7
-
-
74549187742
-
-
edited by P. rsky, J. Paldus, and J. Pittner (Springer, Berlin)
-
Recent Progress in Coupled Cluster Methods: Theory and Applications, edited by, P. rsky, J. Paldus, and, J. Pittner, (Springer, Berlin, 2010).
-
(2010)
Recent Progress in Coupled Cluster Methods: Theory and Applications
-
-
-
8
-
-
85134283262
-
-
in, edited by C. E. Dykstra, G. Frenking, K. S. Kim, and G. E. Scuseria (Elsevier, Amsterdam), Cha 7
-
J. Paldus, in Theory and Applications of Computational Chemistry: The First Forty Years, edited by, C. E. Dykstra, G. Frenking, K. S. Kim, and, G. E. Scuseria, (Elsevier, Amsterdam, 2005), Chap. 7, pp. 115-147.
-
(2005)
Theory and Applications of Computational Chemistry: The First Forty Years
, pp. 115-147
-
-
Paldus, J.1
-
9
-
-
84885145606
-
-
in, edited by C. E. Dykstra, G. Frenking, K. S. Kim, and G. E. Scuseria (Elsevier, Amsterdam), Cha 42
-
R. J. Bartlett, in Theory and Applications of Computational Chemistry: The First Forty Years, edited by, C. E. Dykstra, G. Frenking, K. S. Kim, and, G. E. Scuseria, (Elsevier, Amsterdam, 2005), Chap. 42, pp. 1191-1221.
-
(2005)
Theory and Applications of Computational Chemistry: The First Forty Years
, pp. 1191-1221
-
-
Bartlett, R.J.1
-
10
-
-
29144514711
-
Renormalized coupled-cluster methods exploiting left eigenstates of the similarity-transformed Hamiltonian
-
DOI 10.1063/1.2137318, 224105
-
P. Piecuch and M. Woch, J. Chem. Phys. 123, 224105 (2005). 10.1063/1.2137318 (Pubitemid 41816305)
-
(2005)
Journal of Chemical Physics
, vol.123
, Issue.22
, pp. 1-10
-
-
Piecuch, P.1
Wloch, M.2
-
11
-
-
31044441164
-
Single-reference, size-extensive, non-iterative coupled-cluster approaches to bond breaking and biradicals
-
DOI 10.1016/j.cplett.2005.10.116, PII S0009261405016672
-
P. Piecuch, M. Woch, J. R. Gour, and A. Kinal, Chem. Phys. Lett. 418, 467 (2006). 10.1016/j.cplett.2005.10.116 (Pubitemid 43121301)
-
(2006)
Chemical Physics Letters
, vol.418
, Issue.4-6
, pp. 467-474
-
-
Piecuch, P.1
Wloch, M.2
Gour, J.R.3
Kinal, A.4
-
12
-
-
36348992572
-
Extension of the renormalized coupled-cluster methods exploiting left eigenstates of the similarity-transformed hamiltonian to open-shell systems: A benchmark study
-
DOI 10.1021/jp072535l
-
M. Woch, J. R. Gour, and P. Piecuch, J. Phys. Chem. A 111, 11359 (2007). 10.1021/jp072535l (Pubitemid 350153481)
-
(2007)
Journal of Physical Chemistry A
, vol.111
, Issue.44
, pp. 11359-11382
-
-
Wloch, M.1
Gour, J.R.2
Piecuch, P.3
-
14
-
-
38849092716
-
Improving upon CCSD(T): CCSD (T). I. Potential energy surfaces
-
DOI 10.1063/1.2830236
-
A. G. Taube and R. J. Bartlett, J. Chem. Phys. 128, 044110 (2008). 10.1063/1.2830236 (Pubitemid 351191590)
-
(2008)
Journal of Chemical Physics
, vol.128
, Issue.4
, pp. 044110
-
-
Taube, A.G.1
Bartlett, R.J.2
-
15
-
-
38849142023
-
Improving upon CCSD(T): CCSD (T). II. Stationary formulation and derivatives
-
DOI 10.1063/1.2830237
-
A. G. Taube and R. J. Bartlett, J. Chem. Phys. 128, 044111 (2008). 10.1063/1.2830237 (Pubitemid 351191591)
-
(2008)
Journal of Chemical Physics
, vol.128
, Issue.4
, pp. 044111
-
-
Taube, A.G.1
Bartlett, R.J.2
-
18
-
-
0035827741
-
The active-space equation-of-motion coupled-cluster methods for excited electronic states: Full EOMCCSDt
-
DOI 10.1063/1.1378323
-
K. Kowalski and P. Piecuch, J. Chem. Phys. 115, 643 (2001). 10.1063/1.1378323 (Pubitemid 32680597)
-
(2001)
Journal of Chemical Physics
, vol.115
, Issue.2
, pp. 643-651
-
-
Kowalski, K.1
Piecuch, P.2
-
20
-
-
26444610057
-
Active-space equation-of-motion coupled-cluster methods for excited states of radicals and other open-shell systems: EA-EOMCCSDt and IP-EOMCCSDt
-
DOI 10.1063/1.2042452, 134113
-
J. R. Gour, P. Piecuch, and M. Woch, J. Chem. Phys. 123, 134113 (2005). 10.1063/1.2042452 (Pubitemid 41434701)
-
(2005)
Journal of Chemical Physics
, vol.123
, Issue.13
, pp. 1-14
-
-
Gour, J.R.1
Piecuch, P.2
Wloch, M.3
-
21
-
-
22944466115
-
Automated generation of coupled-cluster diagrams: Implementation in the multireference state-specific coupled-cluster approach with the complete-active-space reference
-
DOI 10.1063/1.1824897, 024108
-
D. I. Lyakh, V. V. Ivanov, and L. Adamowicz, J. Chem. Phys. 122, 024108 (2005). 10.1063/1.1824897 (Pubitemid 41047686)
-
(2005)
Journal of Chemical Physics
, vol.122
, Issue.2
, pp. 1-13
-
-
Lyakh, D.I.1
Ivanov, V.V.2
Adamowicz, L.3
-
22
-
-
39749112706
-
A generalization of the state-specific complete-active-space coupled-cluster method for calculating electronic excited states
-
DOI 10.1063/1.2828548
-
D. I. Lyakh, V. V. Ivanov, and L. Adamowicz, J. Chem. Phys. 128, 074101 (2008). 10.1063/1.2828548 (Pubitemid 351304937)
-
(2008)
Journal of Chemical Physics
, vol.128
, Issue.7
, pp. 074101
-
-
Lyakh, D.I.1
Ivanov, V.V.2
Adamowicz, L.3
-
23
-
-
85073191108
-
-
in, edited by P. rsky, J. Paldus, and J. Pittner (Springer, Berlin), Cha 9
-
V. V. Ivanov, D. I. Lyakh, and L. Adamowicz, in Recent Progress in Coupled Cluster Methods: Theory and Applications, edited by, P. rsky, J. Paldus, and, J. Pittner, (Springer, Berlin, 2010), Chap. 9, pp. 219-249.
-
(2010)
Recent Progress in Coupled Cluster Methods: Theory and Applications
, pp. 219-249
-
-
Ivanov, V.V.1
Lyakh, D.I.2
Adamowicz, L.3
-
24
-
-
0346900424
-
-
10.1063/1.474289
-
X. Li and J. Paldus, J. Chem. Phys. 107, 6257 (1997). 10.1063/1.474289
-
(1997)
J. Chem. Phys.
, vol.107
, pp. 6257
-
-
Li, X.1
Paldus, J.2
-
26
-
-
49349097994
-
-
10.1063/1.2961033
-
X. Li and J. Paldus, J. Chem. Phys. 129, 054104 (2008). 10.1063/1.2961033
-
(2008)
J. Chem. Phys.
, vol.129
, pp. 054104
-
-
Li, X.1
Paldus, J.2
-
28
-
-
0012126914
-
-
10.1016/S0065-3276(08)60040-4
-
J. Paldus and J. ek, Adv. Quantum Chem. 9, 105 (1975). 10.1016/S0065-3276(08)60040-4
-
(1975)
Adv. Quantum Chem.
, vol.9
, pp. 105
-
-
Paldus, J.1
Ek, J.2
-
34
-
-
37549014315
-
Equation-of-motion coupled-cluster methods for open-shell and electronically excited species: The Hitchhiker's guide to fock space
-
DOI 10.1146/annurev.physchem.59.032607.093602
-
A. I. Krylov, Annu. Rev. Phys. Chem. 59, 433 (2008). 10.1146/annurev. physchem.59.032607.093602 (Pubitemid 351703394)
-
(2008)
Annual Review of Physical Chemistry
, vol.59
, pp. 433-462
-
-
Krylov, A.I.1
-
35
-
-
59349118495
-
-
10.1063/1.3066652
-
D. Casanova, L. V. Slipchenko, A. I. Krylov, and M. Head-Gordon, J. Chem. Phys. 130, 044103 (2009). 10.1063/1.3066652
-
(2009)
J. Chem. Phys.
, vol.130
, pp. 044103
-
-
Casanova, D.1
Slipchenko, L.V.2
Krylov, A.I.3
Head-Gordon, M.4
-
37
-
-
57149124103
-
-
10.1021/jp800577q
-
O. Demel, K. R. Shamasundar, L. Kong, and M. Nooijen, J. Phys. Chem. A 112, 11895 (2008). 10.1021/jp800577q
-
(2008)
J. Phys. Chem. A
, vol.112
, pp. 11895
-
-
Demel, O.1
Shamasundar, K.R.2
Kong, L.3
Nooijen, M.4
-
38
-
-
0000186252
-
-
in, edited by D. R. Yarkony (World Scientific, Singapore), Cha 13
-
J. Olsen and P. Jrgensen, in Modern Electronic Structure Theory, Part II, edited by, D. R. Yarkony, (World Scientific, Singapore, 1995), Chap. 13, pp. 857-990.
-
(1995)
Modern Electronic Structure Theory, Part II
, pp. 857-990
-
-
Olsen, J.1
Jrgensen, P.2
-
40
-
-
0002283055
-
-
in, edited by J. Leszczynski (World Scientific, Singapore), Vol., Cha 2
-
H. Nakatsuji, in Computational Chemistry: Reviews of Current Trends, edited by, J. Leszczynski, (World Scientific, Singapore, 1997), Vol. 2, Chap. 2, pp. 62-124.
-
(1997)
Computational Chemistry: Reviews of Current Trends
, vol.2
, pp. 62-124
-
-
Nakatsuji, H.1
-
41
-
-
85073200928
-
-
in, edited by P. rsky, J. Paldus, and J. Pittner (Springer, Berlin), Cha 4
-
M. Ehara and H. Nakatsuji, in Recent Progress in Coupled Cluster Methods: Theory and Applications, edited by, P. rsky, J. Paldus, and, J. Pittner, (Springer, Berlin, 2010), Chap. 4, pp. 79-112.
-
(2010)
Recent Progress in Coupled Cluster Methods: Theory and Applications
, pp. 79-112
-
-
Ehara, M.1
Nakatsuji, H.2
-
42
-
-
84893169025
-
-
10.1002/jcc.540141112
-
M. W. Schmidt, K. K. Baldridge, J. A. Boatz, S. T. Elbert, M. S. Gordon, J. H. Jensen, S. Koseki, N. Matsunaga, K. A. Nguyen, S. J. Su, T. L. Windus, M. Dupuis, and J. A. Montgomery, J. Comput. Chem. 14, 1347 (1993). 10.1002/jcc.540141112
-
(1993)
J. Comput. Chem.
, vol.14
, pp. 1347
-
-
Schmidt, M.W.1
Baldridge, K.K.2
Boatz, J.A.3
Elbert, S.T.4
Gordon, M.S.5
Jensen, J.H.6
Koseki, S.7
Matsunaga, N.8
Nguyen, K.A.9
Su, S.J.10
Windus, T.L.11
Dupuis, M.12
Montgomery, J.A.13
-
43
-
-
34247584617
-
Active-space symmetry-adapted-cluster configuration-interaction and equation-of-motion coupled-cluster methods for high accuracy calculations of potential energy surfaces of radicals
-
DOI 10.1063/1.2723121
-
Y. Ohtsuka, P. Piecuch, J. R. Gour, M. Ehara, and H. Nakatsuji, J. Chem. Phys. 126, 164111 (2007). 10.1063/1.2723121 (Pubitemid 46685441)
-
(2007)
Journal of Chemical Physics
, vol.126
, Issue.16
, pp. 164111
-
-
Ohtsuka, Y.1
Piecuch, P.2
Gour, J.R.3
Ehara, M.4
Nakatsuji, H.5
-
44
-
-
0035829678
-
Coupled-cluster theory for excited electronic states: The full equation-of-motion coupled-cluster single, double, and triple excitation method
-
DOI 10.1063/1.1416173
-
S. A. Kucharski, M. Woch, M. Musia, and R. J. Bartlett, J. Chem. Phys. 115, 8263 (2001). 10.1063/1.1416173 (Pubitemid 33084365)
-
(2001)
Journal of Chemical Physics
, vol.115
, Issue.18
, pp. 8263-8266
-
-
Kucharski, S.A.1
Wloch, M.2
Musial, M.3
Bartlett, R.J.4
-
47
-
-
0002991028
-
-
10.1016/0370-1573(87)90073-1
-
I. Lindgren and D. Mukherjee, Phys. Rep. 151, 93 (1987). 10.1016/0370-1573(87)90073-1
-
(1987)
Phys. Rep.
, vol.151
, pp. 93
-
-
Lindgren, I.1
Mukherjee, D.2
-
49
-
-
74549187742
-
-
in, edited by P. rsky, J. Paldus, and J. Pittner (Springer, Berlin), Cha 15
-
L. Meissner and M. Musia, in Recent Progress in Coupled Cluster Methods: Theory and Applications, edited by, P. rsky, J. Paldus, and, J. Pittner, (Springer, Berlin, 2010), Chap. 15, pp. 395-428.
-
(2010)
Recent Progress in Coupled Cluster Methods: Theory and Applications
, pp. 395-428
-
-
Meissner, L.1
Musia, M.2
-
51
-
-
26444462588
-
An exponential multireference wave-function Ansatz
-
DOI 10.1063/1.1953407, 084102
-
M. Hanrath, J. Chem. Phys. 123, 084102 (2005). 10.1063/1.1953407 (Pubitemid 41417640)
-
(2005)
Journal of Chemical Physics
, vol.123
, Issue.8
, pp. 1-12
-
-
Hanrath, M.1
-
52
-
-
74549187742
-
-
in, edited by P. rsky, J. Paldus, and J. Pittner (Springer, Berlin), Cha 7
-
M. Hanrath, in Recent Progress in Coupled Cluster Methods: Theory and Applications, edited by, P. rsky, J. Paldus, and, J. Pittner, (Springer, Berlin, 2010), Chap. 7, pp. 175-190.
-
(2010)
Recent Progress in Coupled Cluster Methods: Theory and Applications
, pp. 175-190
-
-
Hanrath, M.1
-
53
-
-
84857036581
-
-
in, edited by P. rsky, J. Paldus, and J. Pittner (Springer, Berlin), Cha 17
-
J. Paldus, J. Pittner, and P. rsky, in Recent Progress in Coupled Cluster Methods: Theory and Applications, edited by, P. rsky, J. Paldus, and, J. Pittner, (Springer, Berlin, 2010), Chap. 17, pp. 455-489.
-
(2010)
Recent Progress in Coupled Cluster Methods: Theory and Applications
, pp. 455-489
-
-
Paldus, J.1
Pittner, J.2
Rsky, P.3
-
56
-
-
77955751449
-
-
10.1063/1.3451074
-
X. Li and J. Paldus, J. Chem. Phys. 133, 024102 (2010). 10.1063/1.3451074
-
(2010)
J. Chem. Phys.
, vol.133
, pp. 024102
-
-
Li, X.1
Paldus, J.2
-
57
-
-
78449297027
-
-
10.1063/1.3494538
-
X. Li and J. Paldus, J. Chem. Phys. 133, 184106 (2010). 10.1063/1.3494538
-
(2010)
J. Chem. Phys.
, vol.133
, pp. 184106
-
-
Li, X.1
Paldus, J.2
-
59
-
-
0001435137
-
-
10.1016/S0065-3276(08)60507-9
-
U. S. Mahapatra, B. Datta, B. Bandyopadhyay, and D. Mukherjee, Adv. Quantum Chem. 30, 163 (1998). 10.1016/S0065-3276(08)60507-9
-
(1998)
Adv. Quantum Chem.
, vol.30
, pp. 163
-
-
Mahapatra, U.S.1
Datta, B.2
Bandyopadhyay, B.3
Mukherjee, D.4
-
62
-
-
1942534730
-
-
10.1063/1.1650328
-
S. Chattopadhyay, D. Pahari, D. Mukherjee, and U. S. Mahapatra, J. Chem. Phys. 120, 5968 (2004). 10.1063/1.1650328
-
(2004)
J. Chem. Phys.
, vol.120
, pp. 5968
-
-
Chattopadhyay, S.1
Pahari, D.2
Mukherjee, D.3
Mahapatra, U.S.4
-
64
-
-
0006842423
-
-
in, edited by R. J. Bartlett (World Scientific, Singapore)
-
U. S. Mahapatra, B. Datta, and D. Mukherjee, in Recent Advances in Coupled Cluster Methods, edited by, R. J. Bartlett, (World Scientific, Singapore, 1997), pp. 155-181.
-
(1997)
Recent Advances in Coupled Cluster Methods
, pp. 155-181
-
-
Mahapatra, U.S.1
Datta, B.2
Mukherjee, D.3
-
65
-
-
33750147317
-
High-order excitations in state-universal and state-specific multireference coupled cluster theories: Model systems
-
DOI 10.1063/1.2357923
-
F. A. Evangelista, W. D. Allen, and H. F. Schaefer III, J. Chem. Phys. 125, 154113 (2006). 10.1063/1.2357923 (Pubitemid 44601787)
-
(2006)
Journal of Chemical Physics
, vol.125
, Issue.15
, pp. 154113
-
-
Evangelista, F.A.1
Allen, W.D.2
Schaefer III, H.F.3
-
66
-
-
34547179349
-
Coupling term derivation and general implementation of state-specific multireference coupled cluster theories
-
DOI 10.1063/1.2743014
-
F. A. Evangelista, W. D. Allen, and H. F. Schaefer III, J. Chem. Phys. 127, 024102 (2007). 10.1063/1.2743014 (Pubitemid 47114632)
-
(2007)
Journal of Chemical Physics
, vol.127
, Issue.2
, pp. 024102
-
-
Evangelista, F.A.1
Allen, W.D.2
Schaefer, H.F.3
-
67
-
-
41549112446
-
Triple excitations in state-specific multireference coupled cluster theory: Application of Mk-MRCCSDT and Mk-MRCCSDT-n methods to model systems
-
DOI 10.1063/1.2834927
-
F. A. Evangelista, A. C. Simmonett, W. D. Allen, H. F. Schaefer III, and J. Gauss, J. Chem. Phys. 128, 124104 (2008). 10.1063/1.2834927 (Pubitemid 351474061)
-
(2008)
Journal of Chemical Physics
, vol.128
, Issue.12
, pp. 124104
-
-
Evangelista, F.A.1
Simmonett, A.C.2
Allen, W.D.3
Schaefer, H.F.4
Gauss, J.5
-
68
-
-
56349095890
-
-
Nair, 10.1063/1.3006401
-
K. Bhaskaran -Nair, O. Demel, and J. Pittner, J. Chem. Phys. 129, 184105 (2008). 10.1063/1.3006401
-
(2008)
J. Chem. Phys.
, vol.129
, pp. 184105
-
-
Bhaskaran, K.1
Demel, O.2
Pittner, J.3
-
70
-
-
79955393447
-
-
10.1063/1.3573373
-
K. Bhaskaran-Nair, O. Demel, J. mydke, and J. Pittner, J. Chem. Phys. 134, 154106 (2011). 10.1063/1.3573373
-
(2011)
J. Chem. Phys.
, vol.134
, pp. 154106
-
-
Bhaskaran-Nair, K.1
Demel, O.2
Mydke, J.3
Pittner, J.4
-
72
-
-
85073247415
-
-
in, edited by P. rsky, J. Paldus, and J. Pittner (Springer, Berlin), Cha 3
-
S. Das, S. Pathak, R. Maitra, and D. Mukherjee, in Recent Progress in Coupled Cluster Methods: Theory and Applications, edited by, P. rsky, J. Paldus, and, J. Pittner, (Springer, Berlin, 2010), Chap. 3, pp. 57-77.
-
(2010)
Recent Progress in Coupled Cluster Methods: Theory and Applications
, pp. 57-77
-
-
Das, S.1
Pathak, S.2
Maitra, R.3
Mukherjee, D.4
-
73
-
-
77149138815
-
-
10.1063/1.3305335
-
F. A Evangelista, E. Prochnow, J. Gauss, and H. F. Schaefer, J. Chem. Phys. 132, 074107 (2010). 10.1063/1.3305335
-
(2010)
J. Chem. Phys.
, vol.132
, pp. 074107
-
-
Evangelista, F.A.1
Prochnow, E.2
Gauss, J.3
Schaefer, H.F.4
-
74
-
-
0141921915
-
-
10.1063/1.1599283
-
X. Li and J. Paldus, J. Chem. Phys. 119, 5320 (2003). 10.1063/1.1599283
-
(2003)
J. Chem. Phys.
, vol.119
, pp. 5320
-
-
Li, X.1
Paldus, J.2
-
75
-
-
0141887375
-
-
10.1063/1.1599335
-
X. Li and J. Paldus, J. Chem. Phys. 119, 5346 (2003). 10.1063/1.1599335
-
(2003)
J. Chem. Phys.
, vol.119
, pp. 5346
-
-
Li, X.1
Paldus, J.2
-
77
-
-
3142713715
-
General-model-space state-universal coupled-cluster method: Diagrammatic approach
-
DOI 10.1023/B:JOMC.0000033257.87377.1f
-
J. Paldus, X. Li, and N. D. K. Petraco, J. Math. Chem. 35, 213 (2004). 10.1023/B:JOMC.0000033257.87377.1f (Pubitemid 38918914)
-
(2004)
Journal of Mathematical Chemistry
, vol.35
, Issue.3
, pp. 215-251
-
-
Paldus, J.1
Li, X.2
Petraco, N.D.K.3
-
78
-
-
0141991035
-
-
10.1063/1.1599302
-
X. Li and J. Paldus, J. Chem. Phys. 119, 5334 (2003). 10.1063/1.1599302
-
(2003)
J. Chem. Phys.
, vol.119
, pp. 5334
-
-
Li, X.1
Paldus, J.2
-
79
-
-
33645775232
-
-
10.1080/00268970500416145
-
X. Li and J. Paldus, Mol. Phys. 104, 661 (2006). 10.1080/ 00268970500416145
-
(2006)
Mol. Phys.
, vol.104
, pp. 661
-
-
Li, X.1
Paldus, J.2
-
80
-
-
33646502516
-
-
in, edited by J.-P. Julien, J. Maruani, D. Mayou, G. Delgado-Barrio, and S. Wilson (Springer, Berlin), Vol
-
J. Paldus and X. Li, in Recent Advances in the Theory of Chemical and Physical Systems: Progress in Theoretical Chemistry and Physics, edited by, J.-P. Julien, J. Maruani, D. Mayou, G. Delgado-Barrio, and, S. Wilson, (Springer, Berlin, 2006), Vol. 15, pp. 13-44.
-
(2006)
Recent Advances in the Theory of Chemical and Physical Systems: Progress in Theoretical Chemistry and Physics
, vol.15
, pp. 13-44
-
-
Paldus, J.1
Li, X.2
-
81
-
-
33745612727
-
Diagonal perturbative triple corrections to the general-model-space state-universal coupled-cluster method: Are they warranted and useful?
-
DOI 10.1080/00268970600659560, PII W218183918421663
-
X. Li and J. Paldus, Mol. Phys. 104, 2047 (2006). 10.1080/ 00268970600659560 (Pubitemid 43982588)
-
(2006)
Molecular Physics
, vol.104
, Issue.13-14
, pp. 2047-2062
-
-
Li, X.1
Paldus, J.2
-
82
-
-
31144431899
-
General-model-space state-universal coupled-cluster methods for excited states: Diagonal noniterative triple corrections
-
DOI 10.1063/1.2151893, 034112
-
X. Li and J. Paldus, J. Chem. Phys. 124, 034112 (2006). 10.1063/1.2151893 (Pubitemid 43133755)
-
(2006)
Journal of Chemical Physics
, vol.124
, Issue.3
, pp. 1-14
-
-
Li, X.1
Paldus, J.2
-
83
-
-
78649624619
-
-
10.1080/00268976.2010.524169
-
B. Jeziorski, Mol. Phys. 108, 3043 (2010). 10.1080/00268976.2010.524169
-
(2010)
Mol. Phys.
, vol.108
, pp. 3043
-
-
Jeziorski, B.1
-
85
-
-
33750362705
-
2: Simple yet exceptional systems for advanced correlated methods
-
DOI 10.1016/j.cplett.2006.09.053, PII S0009261406014011
-
X. Li and J. Paldus, Chem. Phys. Lett. 431, 179 (2006). 10.1016/j.cplett.2006.09.053 (Pubitemid 44632993)
-
(2006)
Chemical Physics Letters
, vol.431
, Issue.1-3
, pp. 179-184
-
-
Li, X.1
Paldus, J.2
-
86
-
-
48749092040
-
-
10.1016/j.cplett.2008.07.004
-
X. Li, J. R. Gour, J. Paldus, and P. Piecuch, Chem. Phys. Lett. 461, 321 (2008). 10.1016/j.cplett.2008.07.004
-
(2008)
Chem. Phys. Lett.
, vol.461
, pp. 321
-
-
Li, X.1
Gour, J.R.2
Paldus, J.3
Piecuch, P.4
-
88
-
-
0000060013
-
-
10.1016/0009-2614(86)87050-6
-
D. Mukherjee, Chem. Phys. Lett. 125, 207 (1986). 10.1016/0009-2614(86) 87050-6
-
(1986)
Chem. Phys. Lett.
, vol.125
, pp. 207
-
-
Mukherjee, D.1
-
92
-
-
0038216611
-
-
10.1063/1.1560133
-
J. Paldus and X. Li, J. Chem. Phys. 118, 6769 (2003). 10.1063/1.1560133
-
(2003)
J. Chem. Phys.
, vol.118
, pp. 6769
-
-
Paldus, J.1
Li, X.2
-
94
-
-
0000079402
-
-
10.1080/002689798168529
-
G. Peris, F. Rajadell, X. Li, J. Planelles, and J. Paldus, Mol. Phys. 94, 235 (1998). 10.1080/002689798168529
-
(1998)
Mol. Phys.
, vol.94
, pp. 235
-
-
Peris, G.1
Rajadell, F.2
Li, X.3
Planelles, J.4
Paldus, J.5
-
95
-
-
0002647127
-
-
in, edited by P. R. Surjn (Springer, Berlin), Vol
-
J. Paldus and X. Li, in Correlation and Localization, Topics in Current Chemistry, edited by, P. R. Surjn, (Springer, Berlin, 1999), Vol. 203, pp. 1-20.
-
(1999)
Correlation and Localization, Topics in Current Chemistry
, vol.203
, pp. 1-20
-
-
Paldus, J.1
Li, X.2
-
96
-
-
24044526317
-
Multi-reference Brillouin-Wigner coupled-cluster method with a general model space
-
DOI 10.1080/01449290500102169
-
J. Pittner, X. Li, and J. Paldus, Mol. Phys. 103, 2239 (2005). 10.1080/01449290500102169 (Pubitemid 41647960)
-
(2005)
Molecular Physics
, vol.103
, Issue.15-16
, pp. 2239-2245
-
-
Pittner, J.1
Li, X.2
Paldus, J.3
-
97
-
-
77955558453
-
-
10.1016/j.cplett.2010.07.028
-
X. Li and J. Paldus, Chem. Phys. Lett. 496, 183 (2010). 10.1016/j.cplett.2010.07.028
-
(2010)
Chem. Phys. Lett.
, vol.496
, pp. 183
-
-
Li, X.1
Paldus, J.2
-
100
-
-
0036887904
-
Efficient computer implementation of the renormalized coupled-cluster methods: The R-CCSD[T], R-CCSD(T), CR-CCSD[T], and CR-CCSD(T) approaches
-
DOI 10.1016/S0010-4655(02)00598-2, PII S0010465502005982
-
P. Piecuch, S. A. Kucharski, K. Kowalski, and M. Musia, Comput. Phys. Commun. 149, 71 (2002). 10.1016/S0010-4655(02)00598-2 (Pubitemid 35214501)
-
(2002)
Computer Physics Communications
, vol.149
, Issue.2
, pp. 71-96
-
-
Piecuch, P.1
Kucharski, S.A.2
Kowalski, K.3
Musial, M.4
-
102
-
-
0031568159
-
Polarization propagator study of electronic excitation in key heterocyclic moleculesI. Pyrrole
-
DOI 10.1016/S0301-0104(96)00303-5
-
A. B. Trofimov and J. Schirmer, Chem. Phys. 214, 153 (1997). 10.1016/S0301-0104(96)00303-5 (Pubitemid 127014298)
-
(1997)
Chemical Physics
, vol.214
, Issue.2-3
, pp. 153-170
-
-
Trofimov, A.B.1
Schirmer, J.2
-
104
-
-
0000094026
-
-
S. Pal, 10.1016/0009-2614(87)80218-X
-
S. Pal, M. Rittby, R. J. Bartlett, D. Sinha, and D. Mukherjee, Chem. Phys. Lett. 137, 273 (1987). 10.1016/0009-2614(87)80218-X
-
(1987)
Chem. Phys. Lett.
, vol.137
, pp. 273
-
-
Rittby, M.1
Bartlett, R.J.2
Sinha, D.3
Mukherjee, D.4
-
110
-
-
0000940719
-
VUV optical-absorption and electron-energy-loss spectroscopy of formamide
-
DOI 10.1016/S0301-0104(97)00137-7
-
J. M. Gingell, N. J. Mason, H. Zhao, I. C. Walker, and M. R. F. Siggel, Chem. Phys. 220, 191 (1997). 10.1016/S0301-0104(97)00137-7 (Pubitemid 127092612)
-
(1997)
Chemical Physics
, vol.220
, Issue.1-2
, pp. 191-206
-
-
Gingell, J.M.1
Mason, N.J.2
Zhao, H.3
Walker, I.C.4
Siggel, M.R.F.5
-
111
-
-
0032533083
-
An efficient implementation of time-dependent density-functional theory for the calculation of excitation energies of large molecules
-
DOI 10.1063/1.477483, PII S0021960698306431
-
R. E. Stratmann, G. E. Scusesia, and M. J. Frisch, J. Chem. Phys. 109, 8218 (1998). 10.1063/1.477483 (Pubitemid 128672179)
-
(1998)
Journal of Chemical Physics
, vol.109
, Issue.19
, pp. 8218-8224
-
-
Stratmann, R.E.1
Scuseria, G.E.2
Frisch, M.J.3
-
112
-
-
0000956526
-
-
10.1139/p56-067
-
P. G. Wilkinson, Can. J. Phys. 34, 596 (1956). 10.1139/p56-067
-
(1956)
Can. J. Phys.
, vol.34
, pp. 596
-
-
Wilkinson, P.G.1
|