-
3
-
-
24944551998
-
-
Neugebauer, J.; Jacob, C. R.; Wesołowski, T. A.; Baerends, E. J. J. Phys. Chem. A 2005, 109, 7805.
-
(2005)
J. Phys. Chem. A
, vol.109
, pp. 7805
-
-
Neugebauer, J.1
Jacob, C.R.2
Wesołowski, T.A.3
Baerends, E.J.4
-
4
-
-
25444472357
-
-
Neugebauer, J.; Louwerse, M. J.; Belanzoni, P.; Wesołowski, T. A.; Baerends, E. J. J. Chem. Phys. 2005, 123, 114101.
-
(2005)
J. Chem. Phys
, vol.123
, pp. 114101
-
-
Neugebauer, J.1
Louwerse, M.J.2
Belanzoni, P.3
Wesołowski, T.A.4
Baerends, E.J.5
-
5
-
-
27644522339
-
-
Jacob, C. R.; Wesołowski, T. A.; Visscher, L. J. Chem. Phys. 2005, 123, 174104.
-
(2005)
J. Chem. Phys
, vol.123
, pp. 174104
-
-
Jacob, C.R.1
Wesołowski, T.A.2
Visscher, L.3
-
6
-
-
7444234781
-
-
Zbiri, M.; Atanasov, M.; Daul, C.; Garcia-Lastra, J. M.; Wesołowski, T. A. Chem. Phys. Lett. 2004, 397, 441.
-
(2004)
Chem. Phys. Lett
, vol.397
, pp. 441
-
-
Zbiri, M.1
Atanasov, M.2
Daul, C.3
Garcia-Lastra, J.M.4
Wesołowski, T.A.5
-
7
-
-
84961978367
-
-
Leopoldini, M.; Russo, N.; Toscano, M.; Dułak, M.; Wesołowski, T. A. Chem. Eur. J. 2006, 12, 2532.
-
(2006)
Chem. Eur. J
, vol.12
, pp. 2532
-
-
Leopoldini, M.1
Russo, N.2
Toscano, M.3
Dułak, M.4
Wesołowski, T.A.5
-
12
-
-
30744460612
-
-
Kevorkyants, R.; Dułak, M.; Wesołowski, T. A. J. Chem. Phys. 2006, 124, 024104.
-
(2006)
J. Chem. Phys
, vol.124
, pp. 024104
-
-
Kevorkyants, R.1
Dułak, M.2
Wesołowski, T.A.3
-
14
-
-
0041946098
-
-
Wesołowski, T. A.; Ellinger, Y.; Weber, J. J. Chem. Phys. 1998, 108, 6078.
-
(1998)
J. Chem. Phys
, vol.108
, pp. 6078
-
-
Wesołowski, T.A.1
Ellinger, Y.2
Weber, J.3
-
15
-
-
0034908122
-
-
Tran, F.; Weber, J.; Wesołowski, T. A. Helv. Chim. Acta 2001, 84, 1489.
-
(2001)
Helv. Chim. Acta
, vol.84
, pp. 1489
-
-
Tran, F.1
Weber, J.2
Wesołowski, T.A.3
-
17
-
-
23244460838
-
-
Perdew, J. P.; Chevary, J. A.; Vosko, S. H.; Jackson, K. A.; Pederson, M. R.; Singh, D. J.; Fiolhais, C. Phys. Rev. B 1992, 46, 6671.
-
(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
-
18
-
-
0001622167
-
-
Perdew, J. P.; Chevary, J. A.; Vosko, S. H.; Jackson, K. A.; Pederson, M. R.; Singh, D. J.; Fiolhais, C. Phys. Rev. B 1993, 48, 4978.
-
(1993)
Phys. Rev. B
, vol.48
, pp. 4978
-
-
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
-
25
-
-
36148935653
-
-
Wesołowski T. A. One-electron equations for embedded electron density: challenge for theory and practical payoffs in multi-level modelling of soft condensed matter; X of Computational Chemistry: Reviews of Current Trends; Leszczynski, J., Ed.; World Scientific: 2006; pp 1-82.
-
Wesołowski T. A. One-electron equations for embedded electron density: challenge for theory and practical payoffs in multi-level modelling of soft condensed matter; volume X of Computational Chemistry: Reviews of Current Trends; Leszczynski, J., Ed.; World Scientific: 2006; pp 1-82.
-
-
-
-
28
-
-
0000216001
-
-
Vosko, S. H.; Wilk, L.; Nusair, M. Can. J. Phys. 1980, 58, 1200.
-
(1980)
Can. J. Phys
, vol.58
, pp. 1200
-
-
Vosko, S.H.1
Wilk, L.2
Nusair, M.3
-
31
-
-
33846238566
-
-
Fermi, E. Z. Phys. 1928, 48, 73.
-
(1928)
Z. Phys
, vol.48
, pp. 73
-
-
Fermi, E.1
-
33
-
-
0000176795
-
-
Wesołowski, T. A.; Chermette, H.; Weber, J. J. Chem. Phys. 1996, 105, 9182.
-
(1996)
J. Chem. Phys
, vol.105
, pp. 9182
-
-
Wesołowski, T.A.1
Chermette, H.2
Weber, J.3
-
38
-
-
36148957546
-
-
Köster, A. M.; Flores-Moreno, R.; Geudtner, G.; Goursot, A.; Heine, T.; Reveles, J. U.; Vela, A.; Salahub, D. R. deMon 2003; NRC, Canada. http://www.deMon-software.com/ (accessed Sep 8, 2006).
-
Köster, A. M.; Flores-Moreno, R.; Geudtner, G.; Goursot, A.; Heine, T.; Reveles, J. U.; Vela, A.; Salahub, D. R. deMon 2003; NRC, Canada. http://www.deMon-software.com/ (accessed Sep 8, 2006).
-
-
-
-
39
-
-
36148969001
-
Adaptive grid technique for computer simulations of condensed matter using orbital-free embedding formalism
-
Simos, T, Maroulis, G, Eds, VSP/Brill
-
Dułak, M.; Wesołowski, T. A. Adaptive grid technique for computer simulations of condensed matter using orbital-free embedding formalism. In Lecture Series on Computer and Computational Sciences Vol. 3; Simos, T., Maroulis, G., Eds.; VSP/Brill: 2005; pp 282-288.
-
(2005)
Lecture Series on Computer and Computational Sciences
, vol.3
, pp. 282-288
-
-
Dułak, M.1
Wesołowski, T.A.2
-
40
-
-
0037422363
-
-
Lynch, B. J.; Zhao, Y.; Truhlar, D. G. J. Phys. Chem. A 2003, 107, 1384.
-
(2003)
J. Phys. Chem. A
, vol.107
, pp. 1384
-
-
Lynch, B.J.1
Zhao, Y.2
Truhlar, D.G.3
-
41
-
-
0001447932
-
-
Gill, P. M. W.; Johnson, B. G.; Pople, J. A. Chem. Phys. Lett. 1993, 209, 506.
-
(1993)
Chem. Phys. Lett
, vol.209
, pp. 506
-
-
Gill, P.M.W.1
Johnson, B.G.2
Pople, J.A.3
-
42
-
-
33846235135
-
-
accessed Sep 8
-
Köster, A. M.; Calaminici, P.; Escalante, S.; Flores-Moreno, R.; Goursot, A.; Patchkovskii, S.; Reveles, J. U.; Salahub, D. R.; Vela, A.; Heine, T. The deMon User's Guide, Version 1.0.3, 2003-2004. http://www.deMon- software.com/ (accessed Sep 8, 2006).
-
(2006)
The deMon User's Guide, Version 1.0.3, 2003-2004
-
-
Köster, A.M.1
Calaminici, P.2
Escalante, S.3
Flores-Moreno, R.4
Goursot, A.5
Patchkovskii, S.6
Reveles, J.U.7
Salahub, D.R.8
Vela, A.9
Heine, T.10
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