Complete basis set limits of local second-order Møller–Plesset perturbation theory

References

• Wilson , A. K. 1995 . Ph.D. thesis , University of Minnesota .
   Google Scholar
• Dolgonos , G. A and Peslherbe , G. H. 211 . Chem. Phys. Lett Vol. 513 , 236 F.R. Manby, J. Chem. Phys. 119, 4607 (2003); T. Korona, D. Kats, M. Schütz, T. Adler, Y. Liu, and H.-J. Werner, in Linear-Scaling Techniques in Computational Chemistry and Physics, edited by R. Zalesny, M.G. Papadopoulos, P.G. Mezey et al. (Springer, Netherlands, 2011); M. Schütz, H.-J. Werner, R. Lindh, and F.R. Manby, J. Chem. Phys. 121, 737 (2004); T.B. Adler, H.-J. Werner, and F.R. Manby, J. Chem. Phys. 130, 054106 (2009); S. Ten-no, Chem. Phys. Lett. 398, 56 (2004); A.J. May, E. Valeev, R. Polly, and F.R. Manby, Phys. Chem. Chem. Phys. 7, 2710 (2005); D.P. Tew and W. Klopper, J. Chem. Phys. 123, 074101 (2005)
   Google Scholar
• Doser , B. , Lambrecht , D. S. , Kussmann , J. and Ochsenfeld , C. 2009 . J. Chem. Phys , 130 : 064107 doi: 10.1063/1.3072903
   PubMed Web of Science ®Google Scholar
• Pulay , P. 1983 . Chem. Phys. Lett , 100 : 151 P. Pulay and S. Saebø, Theor. Chim. Acta 69, 357 (1986); S. Saebø and P. Pulay, J. Chem. Phys. 88, 1884 (1988); S. Saebø and P. Pulay, Ann. Rev. Phys. Chem. 44, 213 (1993) doi: 10.1016/0009-2614(83)80703-9
   Web of Science ®Google Scholar
• Häser , M. and Almlöf , J. 1992 . J. Chem. Phys , 96 : 489 J. Almlöf, Chem. Phys. Lett. 181, 319 (1991) doi: 10.1063/1.462485
   Web of Science ®Google Scholar
• Wilson , A. K. and Almlöf , J. 1997 . Theor. Chim. Acta , 95 : 49
   Google Scholar
• Ayala , P. Y. and Scuseria , G. E. 1999 . J. Chem. Phys , 110 : 3660 P.Y. Ayala, K.N. Kudin, and G.E. Scuseria, J. Chem. Phys. 115, 9698 (2001) doi: 10.1063/1.478256
   Web of Science ®Google Scholar
• Doser , B. , Lambrecht , D. S. , Kussmann , J. and Ochsenfeld , C. 2009 . J. Chem. Phys , 130 : 064107 S.A. Maurer, D.S. Lambrecht, J. Kussmann, and C. Ochsenfeld, J. Chem. Phys. 138, 014101 (2013) doi: 10.1063/1.3072903
   PubMed Web of Science ®Google Scholar
• Lee , M. S. , Maslen , P. E. and Head-Gordon , M. 2000 . J. Chem. Phys , 112 : 3592 doi: 10.1063/1.480512
   Web of Science ®Google Scholar
• Jung , Y. , Lochan , R. C. , Dutoi , A. D. and Head-Gordon , M. 2004 . J. Chem. Phys , 121 : 9793 doi: 10.1063/1.1809602
   PubMed Web of Science ®Google Scholar
• Friesner , R. A. , Murphy , R. B. , Beachy , M. D. , Ringnalda , M. N. , Pollard , W. T. , Dunietz , B. D. and Cao , Y. 1999 . J. Phys. Chem. A , 103 : 1913 doi: 10.1021/jp9825157
   Web of Science ®Google Scholar
• Walter , D. , Szilva , A. B. , Niedfeldt , K. and Carter , E. A. 2002 . J. Chem. Phys , 117 : 1982 doi: 10.1063/1.1487816
   Web of Science ®Google Scholar
• Deng , J. and Gill , P. M.W. 2011 . J. Chem. Phys , 134 : 081103 doi: 10.1063/1.3556705
   PubMed Web of Science ®Google Scholar
• Edmiston , C. and Ruedenberg , K. 1966 . Rev. Mod. Phys , Vol. 35 , 457 New York : Academic Publishing . C. Edmiston and K. Ruedenberg, J. Chem. Phys. 43, S97 (1965); C. Edmiston and K. Reudenberg, in Quantum Theory of Atoms, Molecules and the Solid State, edited by P.O. Löwdin
   Google Scholar
• Boys , S. F. 1966 . Quantum Theory of Atoms, Molecules, and the Solid State , Edited by: Löwdin , P. O. New York : Academic Publishing .
   Google Scholar
• Pipek , J. and Mezey , P. G. 1989 . J. Chem. Phys , 90 : 4916 doi: 10.1063/1.456588
   Web of Science ®Google Scholar
• Pipek , J. 1989 . Int. J. Quantum Chem , 36 : 487 doi: 10.1002/qua.560360405
   Web of Science ®Google Scholar
• Boughton , J. W. and Pulay , P. 1993 . J. Comp. Chem , 14 : 736 doi: 10.1002/jcc.540140615
   Web of Science ®Google Scholar
• Mata , R. A. and Werner , H. -J. 2007 . Mol. Phys , 105 : 2753 doi: 10.1080/00268970701628209
   Web of Science ®Google Scholar
• Werner , H. -J. , Knowles , P. J. , Knizia , G. , Manby , F. R. , Schütz , M. , Celani , P. , Korona , T. , Lindh , R. , Mitrushenkov , A. , Rauhut , G. , Shamasundar , K. R. , Adler , T. B. , Amos , R. D. , Bernhardsson , A. , Berning , A. , Cooper , D. L. , Deegan , M. J.O. , Dobbyn , A. J. , Eckert , F. , Goll , E. , Hampel , C. , Hesselmann , A. , Hetzer , G. , Hrenar , T. , Jansen , G. , Köppl , C. , Liu , Y. , Lloyd , A. W. , Mata , R. A. , May , A. J. , McNicholas , S. J. , Meyer , W. , Mura , M. E. , Nicklaß , A. , O’Neill , D. P. , Palmieri , P. , Pflüger , K. , Pitzer , R. , Reiher , M. , Shiozaki , T. , Stoll , H. , Stone , A. J. , Tarroni , R. , Thorsteinsson , T. , Wang , M. and Wolf , A. 2009 . MOLPRO version a package of ab initio programs, see http://www.molpro.net
   Google Scholar
• Frisch , M. J. , Trucks , G. W. , Schlegel , H. B. , Scuseria , G. E. , Robb , M. A. , Cheeseman , J. R. , Scalmani , G. , Barone , V. , Mennucci , B. , Petersson , G. A. , Nakatsuji , H. C. , Caricato , M. , Li , X. , Hratchian , H. P. , Izmaylov , A. F. , Bloino , J. , Zheng , G. , Sonnenberg , J. L. , Hada , M. , Ehara , M. , Toyota , K. , Fukuda , R. , Hasegawa , J. , Ishida , M. , Nakajima , T. , Honda , Y. , Kitao , O. , Nakai , H. , Vreven , T. , Montgomery , J. A. Jr , Peralta , J. E. , Ogliaro , F. , Bearpark , M. , Heyd , J. J. , Brothers , E. , Kudin , K. N. , Staroverov , V. N. , Kobayashi , R. , Normand , J. , Raghavachari , K. , Rendell , A. , Burant , J. C. , Iyengar , S. S. , Tomasi , J. , Cossi , M. , Rega , N. , Millam , N. J. , Klene , M. , Knox , J. E. , Cross , J. B. , Bakken , V. , Adamo , C. , Jaramillo , J. , Gomperts , R. , Stratmann , R. E. , Yazyev , O. , Austin , A. J. , Cammi , R. , Pomelli , C. , Ochterski , J. W. , Martin , R. L. , Morokuma , K. , Zakrzewski , V. G. , Voth , G. A. , Salvador , P. , Dannenberg , J. J. , Dapprich , S. , Daniels , A. D. , Farkas , Ö. , Foresman , J. B. , Ortiz , J. V. , Cioslowski , J. and Fox , D. J. 2009 . Gaussian 09 , Wallingford , CT : Gaussian, Inc. .
   Google Scholar
• Hampel , C. and Werner , H. -J. 1996 . J. Chem. Phys. , 104 : 6286 G. Hetzer, P. Pulay, and H.-J. Werner, Chem. Phys. Lett. 290, 143 (1998); G. Hetzer, M. Schütz, H. Stoll, and H.-J. Werner, J. Chem. Phys. 113, 9443 (2000); M. Schütz, G. Hetzer, and H.-J. Werner, J. Chem. Phys. 111, 5691 (1999); M. Schütz and H.-J. Werner, J. Chem. Phys. 114, 661 (2001); M. Schütz and H.-J. Werner, Chem. Phys. Lett. 318, 370 (2000); M. Schütz, R. Lindh, and H.-J. Werner, Mol. Phys. 96, 719 (1999); M. Schütz, J. Chem. Phys. 113, 9986 (2000); M. Schütz, J. Chem. Phys. 116, 8772 (2002). doi: 10.1063/1.471289
   Web of Science ®Google Scholar
• Werner , H. -J. and Pflüger , K. 2006 . Annual Reports in Computational Chemistry , Edited by: Spellmeyer , D. C. Amsterdam : Elsevier .
   Google Scholar
• Kaminsky , J. , Mata , R. A. , Werner , H. -J. and Jensen , F. 2008 . Mol. Phys , 106 : 1899 doi: 10.1080/00268970802360355
   Web of Science ®Google Scholar
• Dunning , T. H. Jr. 1989 . J. Chem. Phys , 90 : 1007 K.A. Peterson and T.H. Dunning, Jr., J. Chem. Phys. 117, 10548 (2002); A.K. Wilson, D.E. Woon, K.A. Peterson, and T.H. Dunning, Jr., J. Chem. Phys. 110, 7667 (1999); D.E. Woon and T.H. Dunning, Jr., J. Chem. Phys. 98, 1358 (1993); D.E. Woon and T.H. Dunning, Jr., J. Chem. Phys. 100, 2975 (1994); D.E. Woon and T.H. Dunning, Jr., J. Chem. Phys. 103, 4572 (1995) doi: 10.1063/1.456153
   Web of Science ®Google Scholar
• Dunning , T. H. Jr. , Peterson , K. A. and Wilson , A. K. 2001 . J. Chem. Phys , 114 : 9244 doi: 10.1063/1.1367373
   Web of Science ®Google Scholar
• Löwdin , P. O. 1970 . Adv. Quantum Chem , 5 : 185 doi: 10.1016/S0065-3276(08)60339-1
   Google Scholar
• Cioslowski , J. , Schimeczek , M. , Liu , G. and Stoyanov , V. 2000 . J. Chem. Phys , 113 : 9377 doi: 10.1063/1.1321306
   Web of Science ®Google Scholar
• Schütz , M. , Rauhut , G. and Werner , H. -J. 1998 . J. Phys. Chem. A , 102 : 5997 doi: 10.1021/jp981168y
   Web of Science ®Google Scholar
• Saebo , S. , Tong , W. and Pulay , P. 1993 . J. Chem. Phys , 98 : 2170 doi: 10.1063/1.464195
   Google Scholar
• Feller , D. , Peterson , K. A. and Hill , J. G. 2011 . J. Chem. Phys , 135 : 044102 doi: 10.1063/1.3613639
   PubMed Web of Science ®Google Scholar
• Xantheas , S. S. and Dunning , T. H. Jr. 1993 . J. Phys. Chem , 97 : 18 doi: 10.1021/j100103a005
   Web of Science ®Google Scholar
• Feller , D. 1992 . J. Chem. Phys , 96 : 6104 D. Feller, J. Chem. Phys 98, 7059 (1993) doi: 10.1063/1.462652
   Web of Science ®Google Scholar
• Peterson , K. A. , Woon , D. E. and Dunning , T. H. Jr. 1994 . J. Chem. Phys , 100 : 7410 doi: 10.1063/1.466884
   Web of Science ®Google Scholar
• Schwartz , C. 1963 . Phys. Rev , Vol. 126 , 1015 New York : Academic . C. Schwartz, in Methods in Computational Physics, edited by B.J. Alder, S. Fernbach, and M. Rotenberg
   Google Scholar
• Kutzelnigg , W. and Morgan , J. D. 1992 . J. Chem. Phys , 96 : 4484 doi: 10.1063/1.462811
   Web of Science ®Google Scholar
• Helgaker , T. , Klopper , W. and Koch , H. 1997 . J. Noga, J. Chem. Phys , 106 : 9639 doi: 10.1063/1.473863
   Web of Science ®Google Scholar
• Martin , J. M.L. 1996 . Chem. Phys. Lett , 259 : 669 doi: 10.1016/0009-2614(96)00898-6
   Web of Science ®Google Scholar
• DeYonker , N. J. , Grimes , T. , Yockel , S. , Dinescu , A. , Mintz , B. , Cundari , T. R. and Wilson , A. K. 2006 . J. Chem. Phys , 125 : 104111 doi: 10.1063/1.2236116
   PubMed Web of Science ®Google Scholar