MOLPRO

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Local MP2 (LMP2):
G. Hetzer, P. Pulay, and H.-J. Werner, Chem. Phys. Lett. 290, 143 (1998)
M. Schütz, G. Hetzer, and H.-J. Werner, J. Chem. Phys. 111, 5691 (1999)
G. Hetzer, M. Schütz, H. Stoll, and H.-J. Werner, J. Chem. Phys. 113, 9443 (2000)
See also references on energy gradients and density fitting.
Local Coupled Cluster methods (LCCSD, LQCISD, LMP4):
C. Hampel and H.-J. Werner, J. Chem. Phys. 104 6286 (1996)
M. Schütz and H.-J. Werner, J. Chem. Phys. 114, 661 (2001)
M. Schütz, Phys. Chem. Chem.Phys. 4, 3941 (2002)
See also references on energy gradients and density fitting.
Local triple excitations:
M. Schütz and H.-J. Werner, Chem. Phys. Lett. 318, 370 (2000);
M. Schütz, J. Chem. Phys. 113, 9986 (2000).
M. Schütz, J. Chem. Phys. 116, 8772 (2002).
Density fitting methods:
DFT, Poisson fitting:
DF-MP2, DF-LMP2:
DF-LCCSD:
DF-HF:
DF-LMP2 gradients:
DF-LCCSD(T):
F. R. Manby, P. J. Knowles, and A. W. Lloyd,
J. Chem. Phys. 115, 9144 (2001).
H.-J. Werner, F. R. Manby, and P. J. Knowles,
J. Chem. Phys. 118, 8149 (2003).
M. Schütz and F. R. Manby,
Phys. Chem. Chem. Phys. 5, 3349 (2003)
R. Polly, H.-J. Werner, F. R. Manby, and Peter J. Knowles,
Mol. Phys. 102, 2311 (2004).
M. Schütz, H.-J. Werner, R. Lindh and F. R. Manby,
J. Chem. Phys. 121, 737 (2004).
H.-J. Werner and M. Schütz,
in prepation.
Explicitly correlated methods with density fitting:
DF-MP2-R12: F. R. Manby, J. Chem. Phys. 119, 4807 (2003).
DF-MP2-F12/2A: A. J. May and F. R. Manby, J. Chem. Phys. 121, 4479 (2004).
DF-MP2-F12: H.-J. Werner, T. B. Adler, and F. R. Manby, J. Chem. Phys. 126,
164102 (2007).
DF-RMP2-F12: G. Knizia and H.-J. Werner, J. Chem. Phys. 128, 154103 (2008).
DF-LMP2-F12: H.-J. Werner and F. R. Manby, J. Chem. Phys., 124, 054114 (2006);
F. R. Manby H.-J. Werner, T. B. Adler, and A. J. May, J. Chem. Phys.
124, 094103 (2006); H.-J. Werner, T. B. Adler, and F. R. Manby, J.
Chem. Phys. 126, 164102 (2007); T. B. Adler, H.-J. Werner, and F.
R. Manby, J. Chem. Phys. 130, 054106 (2009).
CCSD(T)-F12: T. B. Adler, G. Knizia, and H.-J. Werner, J. Chem. Phys. 127, 221106
(2007).
UCCSD(T)-F12: G. Knizia, T. B. Adler, and H.-J. Werner, J. Chem. Phys. 130, 054104
(2009).