SCOPUS 정보 검색 플랫폼

Journal of Chemical Theory and Computation

Volumn 8, Issue 7, 2012, Pages 2310-2319

Exchange-correlation functional with good accuracy for both structural and energetic properties while depending only on the density and its gradient

(2) Peverati, Roberto a Truhlar, Donald G a

a University of Minnesota (United States)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 84863675503 PISSN: 15499618 EISSN: 15499626 Source Type: Journal
DOI: 10.1021/ct3002656 Document Type: Article

Times cited : (279)

References (89)

1
- 5944261746
- Perdew, J. P. Phys. Rev. B 1986, 33, 8822-8824
- (1986) Phys. Rev. B , vol.33 , pp. 8822-8824
- Perdew, J.P.¹

2
- 19844383203
- Perdew, J. P.; Schmidt, K. AIP Conf. Proc. 2001, 577, 1-20
- (2001) AIP Conf. Proc , vol.577 , pp. 1-20
- Perdew, J.P.¹ Schmidt, K.²

3
- 80755176390
- Fabiano, E.; Constantin, L. A.; Della Sala, F. J. Chem. Theory Comput. 2011, 7, 3548-3559
- (2011) J. Chem. Theory Comput , vol.7 , pp. 3548-3559
- Fabiano, E.¹ Constantin, L.A.² Della Sala, F.³

4
- 43949098260
- Zhao, Y.; Truhlar, D. G. J. Chem. Phys. 2008, 128, 184109
- (2008) J. Chem. Phys , vol.128 , pp. 184109
- Zhao, Y.¹ Truhlar, D.G.²

5
- 41849095114
- Perdew, J. P.; Ruzsinszky, A.; Csonka, G. I.; Vydrov, O. A.; Scuseria, G. E.; Constantin, L. A.; Zhou, X.; Burke, K. Phys. Rev. Lett. 2008, 100, 136406
- (2008) Phys. Rev. Lett , vol.100 , pp. 136406
- Perdew, J.P.¹ Ruzsinszky, A.² Csonka, G.I.³ Vydrov, O.A.⁴ Scuseria, G.E.⁵ Constantin, L.A.⁶ Zhou, X.⁷ Burke, K.⁸

6
- 59949095600
- Perdew, J. P.; Ruzsinszky, A.; Csonka, G.; Vydrov, O.; Scuseria, G. E.; Constantin, L.; Zhou, X.; Burke, K. Phys. Rev. Lett. 2009, 102, 039902
- (2009) Phys. Rev. Lett , vol.102 , pp. 039902
- Perdew, J.P.¹ Ruzsinszky, A.² Csonka, G.³ Vydrov, O.⁴ Scuseria, G.E.⁵ Constantin, L.⁶ Zhou, X.⁷ Burke, K.⁸

7
- 65649139613
- Csonka, G. I.; Perdew, J. P.; Ruzsinszky, A.; Philipsen, P. H. T.; Lebegue, S.; Paier, J.; Vydrov, O. A.; ángyán, J. G. Phys. Rev. B 2009, 79, 155107
- (2009) Phys. Rev. B , vol.79 , pp. 155107
- Csonka, G.I.¹ Perdew, J.P.² Ruzsinszky, A.³ Philipsen, P.H.T.⁴ Lebegue, S.⁵ Paier, J.⁶ Vydrov, O.A.⁷ Ángyán, J.G.⁸

8
- 65249117699
- Ruzsinszky, A.; Csonka, G. I.; Scuseria, G. E. J. Chem. Theory Comput. 2009, 5, 763-769
- (2009) J. Chem. Theory Comput , vol.5 , pp. 763-769
- Ruzsinszky, A.¹ Csonka, G.I.² Scuseria, G.E.³

9
- 67650544672
- Vela, A.; Medel, V.; Trickey, S. B. J. Chem. Phys. 2009, 130, 244103
- (2009) J. Chem. Phys , vol.130 , pp. 244103
- Vela, A.¹ Medel, V.² Trickey, S.B.³

10
- 77955138386
- Haas, P.; Tran, F.; Blaha, P.; Da Silva, A. J. R.; Odashima, M. M. Phys. Rev. B 2010, 81, 125136
- (2010) Phys. Rev. B , vol.81 , pp. 125136
- Haas, P.¹ Tran, F.² Blaha, P.³ Da Silva, A.J.R.⁴ Odashima, M.M.⁵

11
- 77957555839
- Fabiano, E.; Constantin, L. A.; Della Sala, F. Phys. Rev. B 2010, 82, 113104
- (2010) Phys. Rev. B , vol.82 , pp. 113104
- Fabiano, E.¹ Constantin, L.A.² Della Sala, F.³

12
- 79961110459
- Haas, P.; Tran, F.; Blaha, P.; Schwarz, K. Phys. Rev. B 2011, 83, 205117
- (2011) Phys. Rev. B , vol.83 , pp. 205117
- Haas, P.¹ Tran, F.² Blaha, P.³ Schwarz, K.⁴

13
- 84861666492
- Peverati, R.; Truhlar, D. G. J. Chem. Phys. 2012, 136, 134704
- (2012) J. Chem. Phys , vol.136 , pp. 134704
- Peverati, R.¹ Truhlar, D.G.²

14
- 85026334466
- Perdew, J. P.; Burke, K.; Ernzerhof, M. Phys. Rev. Lett. 1997, 80, 891-891
- (1997) Phys. Rev. Lett , vol.80 , pp. 891-891
- Perdew, J.P.¹ Burke, K.² Ernzerhof, M.³

15
- 33644936253
- Armiento, R.; Mattsson, A. Phys. Rev. B 2005, 72, 085108
- (2005) Phys. Rev. B , vol.72 , pp. 085108
- Armiento, R.¹ Mattsson, A.²

16
- 68749089937
- Perdew, J. P.; Ruzsinszky, A.; Csonka, G. I.; Constantin, L. A.; Sun, J. Phys. Rev. Lett. 2009, 103, 026403
- (2009) Phys. Rev. Lett , vol.103 , pp. 026403
- Perdew, J.P.¹ Ruzsinszky, A.² Csonka, G.I.³ Constantin, L.A.⁴ Sun, J.⁵

17
- 33845328066
- Zhao, Y.; Truhlar, D. G. J. Chem. Phys. 2006, 125, 194101
- (2006) J. Chem. Phys , vol.125 , pp. 194101
- Zhao, Y.¹ Truhlar, D.G.²

18
- 84855459955
- Peverati, R.; Truhlar, D. G. J. Phys. Chem. Lett. 2012, 3, 117-124
- (2012) J. Phys. Chem. Lett , vol.3 , pp. 117-124
- Peverati, R.¹ Truhlar, D.G.²

19
- 0039892284
- Becke, A. D. J. Chem. Phys. 1986, 84, 4524-4529
- (1986) J. Chem. Phys , vol.84 , pp. 4524-4529
- Becke, A.D.¹

20
- 0001393744
- Ortiz, G.; Ballone, P. Phys. Rev. B 1991, 43, 6376-6387
- (1991) Phys. Rev. B , vol.43 , pp. 6376-6387
- Ortiz, G.¹ Ballone, P.²

21
- 0000146437
- Ortiz, G. Phys. Rev. B 1992, 45, 11328-11331
- (1992) Phys. Rev. B , vol.45 , pp. 11328-11331
- Ortiz, G.¹

22
- 4243943295
- Perdew, J. P.; Burke, K.; Ernzerhof, M. Phys. Rev. Lett. 1996, 77, 3865-3868
- (1996) Phys. Rev. Lett , vol.77 , pp. 3865-3868
- Perdew, J.P.¹ Burke, K.² Ernzerhof, M.³

23
- 0001111766
- Antoniewicz, P. R.; Kleinman, L. Phys. Rev. B 1985, 31, 6779-6781
- (1985) Phys. Rev. B , vol.31 , pp. 6779-6781
- Antoniewicz, P.R.¹ Kleinman, L.²

24
- 0002348025
- Ma, S. K.; Brueckner, K. A. Phys. Rev. 1968, 165, 18-31
- (1968) Phys. Rev , vol.165 , pp. 18-31
- Ma, S.K.¹ Brueckner, K.A.²

25
- 80051953449
- Peverati, R.; Zhao, Y.; Truhlar, D. G. J. Phys. Chem. Lett. 2011, 2, 1991-1997
- (2011) J. Phys. Chem. Lett , vol.2 , pp. 1991-1997
- Peverati, R.¹ Zhao, Y.² Truhlar, D.G.³

26
- 0343829008
- Gáspár, R. Acta Phys. Hung. 1974, 35, 213-218
- (1974) Acta Phys. Hung , vol.35 , pp. 213-218
- Gáspár, R.¹

27
- 0042113153
- Kohn, W.; Sham, L. Phys. Rev. 1964, 140, 1133-1138
- (1964) Phys. Rev , vol.140 , pp. 1133-1138
- Kohn, W.¹ Sham, L.²

28
- 4243553426
- Becke, A. D. Phys. Rev. A 1988, 38, 3098-3100
- (1988) Phys. Rev. A , vol.38 , pp. 3098-3100
- Becke, A.D.¹

29
- 0344718335
- Becke, A. D. J. Chem. Phys. 1997, 107, 8554-8560
- (1997) J. Chem. Phys , vol.107 , pp. 8554-8560
- Becke, A.D.¹

30
- 0000225413
- Liu, S.; Parr, R. G. Phys. Rev. A 1997, 55, 1792-1798
- (1997) Phys. Rev. A , vol.55 , pp. 1792-1798
- Liu, S.¹ Parr, R.G.²

31
- 18144378706
- Perdew, J. P.; Yue, W. Phys. Rev. B 1986, 33, 8800-8802
- (1986) Phys. Rev. B , vol.33 , pp. 8800-8802
- Perdew, J.P.¹ Yue, W.²

32
- 0001713395
- Levy, M.; Perdew, J. P. Phys. Rev. A 1985, 32, 2010-2021
- (1985) Phys. Rev. A , vol.32 , pp. 2010-2021
- Levy, M.¹ Perdew, J.P.²

33
- 4243369872
- Ou-Yang, H.; Levy, M. Phys. Rev. A 1990, 42, 155-160
- (1990) Phys. Rev. A , vol.42 , pp. 155-160
- Ou-Yang, H.¹ Levy, M.²

34
- 84859056776
- Chiodo, L.; Constantin, L.; Fabiano, E.; Della Sala, F. Phys. Rev. Lett. 2012, 108, 126402
- (2012) Phys. Rev. Lett , vol.108 , pp. 126402
- Chiodo, L.¹ Constantin, L.² Fabiano, E.³ Della Sala, F.⁴

35
- 33645898818
- Perdew, J. P.; Wang, Y. Phys. Rev. B 1992, 45, 13244-13249
- (1992) Phys. Rev. B , vol.45 , pp. 13244-13249
- Perdew, J.P.¹ Wang, Y.²

36
- 0000759292
- Stoll, H.; Pavlidou, C. Theor. Chim. Acta 1978, 149, 143-149
- (1978) Theor. Chim. Acta , vol.149 , pp. 143-149
- Stoll, H.¹ Pavlidou, C.²

37
- 0002707222
- Stoll, H.; Golka, E. Theor. Chim. Acta 1980, 55, 29-41
- (1980) Theor. Chim. Acta , vol.55 , pp. 29-41
- Stoll, H.¹ Golka, E.²

38
- 0000472229
- Tozer, D. J.; Handy, N. C. J. Phys. Chem. A 1998, 102, 3162-3168
- (1998) J. Phys. Chem. A , vol.102 , pp. 3162-3168
- Tozer, D.J.¹ Handy, N.C.²

39
- 33646464890
- Zhao, Y.; Schultz, N. E.; Truhlar, D. G. J. Chem. Theory Comput. 2005, 2, 364-382
- (2005) J. Chem. Theory Comput , vol.2 , pp. 364-382
- Zhao, Y.¹ Schultz, N.E.² Truhlar, D.G.³

40
- 81855222522
- Peverati, R.; Truhlar, D. G. J. Chem. Phys. 2011, 135, 191102
- (2011) J. Chem. Phys , vol.135 , pp. 191102
- Peverati, R.¹ Truhlar, D.G.²

41
- 79960966012
- Luo, S.; Zhao, Y.; Truhlar, D. G. Phys. Chem. Chem. Phys. 2011, 13, 13683-13689
- (2011) Phys. Chem. Chem. Phys , vol.13 , pp. 13683-13689
- Luo, S.¹ Zhao, Y.² Truhlar, D.G.³

42
- 22744441344
- Zhao, Y.; Truhlar, D. G. J. Phys. Chem. A 2005, 109, 5656-5667
- (2005) J. Phys. Chem. A , vol.109 , pp. 5656-5667
- Zhao, Y.¹ Truhlar, D.G.²

43
- 27344452533
- Zhao, Y.; Schultz, N. E.; Truhlar, D. G. J. Chem. Phys. 2005, 123, 161103
- (2005) J. Chem. Phys , vol.123 , pp. 161103
- Zhao, Y.¹ Schultz, N.E.² Truhlar, D.G.³

44
- 0037422363
- Lynch, B. J.; Zhao, Y.; Truhlar, D. G. J. Phys. Chem. A 2003, 107, 1384-1388
- (2003) J. Phys. Chem. A , vol.107 , pp. 1384-1388
- Lynch, B.J.¹ Zhao, Y.² Truhlar, D.G.³

45
- 33748805997
- Zhao, Y.; Truhlar, D. G. J. Phys. Chem. A 2006, 110, 10478-10486
- (2006) J. Phys. Chem. A , vol.110 , pp. 10478-10486
- Zhao, Y.¹ Truhlar, D.G.²

46
- 24944546573
- Izgorodina, E.; Coote, M.; Radom, L. J. Phys. Chem. A 2005, 109, 7558-7566
- (2005) J. Phys. Chem. A , vol.109 , pp. 7558-7566
- Izgorodina, E.¹ Coote, M.² Radom, L.³

47
- 12444279045
- Zhao, Y.; Lynch, B. J.; Truhlar, D. G. Phys. Chem. Chem. Phys. 2005, 7, 43-52
- (2005) Phys. Chem. Chem. Phys , vol.7 , pp. 43-52
- Zhao, Y.¹ Lynch, B.J.² Truhlar, D.G.³

48
- 15544366274
- Zhao, Y.; González-García, N.; Truhlar, D. G. J. Phys. Chem. A 2005, 109, 2012-2018
- (2005) J. Phys. Chem. A , vol.109 , pp. 2012-2018
- Zhao, Y.¹ González-García, N.² Truhlar, D.G.³

49
- 77249127120
- Zhao, Y.; Truhlar, D. G. J. Chem. Theory Comput. 2005, 1, 415-432
- (2005) J. Chem. Theory Comput , vol.1 , pp. 415-432
- Zhao, Y.¹ Truhlar, D.G.²

50
- 33749607747
- Sinnokrot, M. O.; Sherrill, C. D. J. Phys. Chem. A 2005, 110, 10656-10668
- (2005) J. Phys. Chem. A , vol.110 , pp. 10656-10668
- Sinnokrot, M.O.¹ Sherrill, C.D.²

51
- 43049141516
- Zhao, Y.; Truhlar, D. G. Theor. Chem. Acc. 2008, 120, 215-241
- (2008) Theor. Chem. Acc , vol.120 , pp. 215-241
- Zhao, Y.¹ Truhlar, D.G.²

52
- 25344450852
- Chakravorty, S.; Gwaltney, S.; Davidson, E. R.; Parpia, F.; Fischer, C. Phys. Rev. A 1993, 47, 3649-3670
- (1993) Phys. Rev. A , vol.47 , pp. 3649-3670
- Chakravorty, S.¹ Gwaltney, S.² Davidson, E.R.³ Parpia, F.⁴ Fischer, C.⁵

53
- 70350406958
- University of Minnesota: Minneapolis, MN
- Zhao, Y.; Peverati, R.; Yang, K.; Truhlar, D. G. MN-GFM, version 6.3: Minnesota Gaussian Functional Module; University of Minnesota: Minneapolis, MN, 2012
- (2012) MN-GFM, Version 6.3: Minnesota Gaussian Functional Module
- Zhao, Y.¹ Peverati, R.² Yang, K.³ Truhlar, D.G.⁴

54
- 70450206724
- Revision A.1; Gaussian, Inc. Wallingford, CT
- 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.; 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.; Ogiaro, 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, J. M.; 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, O.; Foresman, J. B.; Ortiz, J. V.; Cioslowski, J.; Fox, D. J. Gaussian 09, Revision A.1; Gaussian, Inc.: Wallingford, CT, 2009
- (2009) Gaussian 09
- Frisch, M.J.¹ Trucks, G.W.² Schlegel, H.B.³ Scuseria, G.E.⁴ Robb, M.A.⁵ Cheeseman, J.R.⁶ Scalmani, G.⁷ Barone, V.⁸ Mennucci, B.⁹ Petersson, G.A.¹⁰ Nakatsuji, H.¹¹ Caricato, M.¹² Li, X.¹³ Hratchian, H.P.¹⁴ Izmaylov, A.F.¹⁵ Bloino, J.¹⁶ Zheng, G.¹⁷ Sonnenberg, J.L.¹⁸ Hada, M.¹⁹ Ehara, M.²⁰ more..

55
- 0000154314
- Kudin, K.; Scuseria, G. E. Phys. Rev. B 2000, 61, 16440-16453
- (2000) Phys. Rev. B , vol.61 , pp. 16440-16453
- Kudin, K.¹ Scuseria, G.E.²

56
- 9944235885
- Sinnokrot, M. O.; Sherrill, C. D. J. Phys. Chem. A 2003, 108, 10200-10207
- (2003) J. Phys. Chem. A , vol.108 , pp. 10200-10207
- Sinnokrot, M.O.¹ Sherrill, C.D.²

57
- 66749135884
- Goerigk, L.; Moellmann, J.; Grimme, S. Phys. Chem. Chem. Phys. 2008, 11, 4611-4620
- (2008) Phys. Chem. Chem. Phys , vol.11 , pp. 4611-4620
- Goerigk, L.¹ Moellmann, J.² Grimme, S.³

58
- 0039209924
- Schafer, A.; Huber, C.; Ahlrichs, R. J. Chem. Phys. 1993, 100, 5829-5835
- (1993) J. Chem. Phys , vol.100 , pp. 5829-5835
- Schafer, A.¹ Huber, C.² Ahlrichs, R.³

59
- 58149236927
- Zhao, Y.; Truhlar, D. G. J. Chem. Theory Comput. 2008, 4, 1849-1868
- (2008) J. Chem. Theory Comput , vol.4 , pp. 1849-1868
- Zhao, Y.¹ Truhlar, D.G.²

60
- 84873055189
- 1 st ed. Wiley: New York
- Radom, L.; Schleyer, P. V. R.; Pople, J. A.; Hehre, W. J. Ab Initio Molecular Orbital Theory; 1 st ed.; Wiley: New York, 1986
- (1986) Ab Initio Molecular Orbital Theory
- Radom, L.¹ Schleyer, P.V.R.² Pople, J.A.³ Hehre, W.J.⁴

61
- 27644519159
- Heyd, J.; Peralta, J. E.; Scuseria, G. E.; Martin, R. J. Chem. Phys. 2005, 123, 174101
- (2005) J. Chem. Phys , vol.123 , pp. 174101
- Heyd, J.¹ Peralta, J.E.² Scuseria, G.E.³ Martin, R.⁴

62
- 83455260609
- Peverati, R.; Truhlar, D. G. J. Chem. Theory Comput. 2011, 7, 3983-3994
- (2011) J. Chem. Theory Comput , vol.7 , pp. 3983-3994
- Peverati, R.¹ Truhlar, D.G.²

63
- 0000216001
- Vosko, S. H.; Wilk, L.; Nusair, M. Can. J. Phys. 1980, 58, 1200-1211
- (1980) Can. J. Phys , vol.58 , pp. 1200-1211
- Vosko, S.H.¹ Wilk, L.² Nusair, M.³

64
- 0035836323
- Handy, N.; Cohen, A. Mol. Phys. 2001, 99, 403-412
- (2001) Mol. Phys , vol.99 , pp. 403-412
- Handy, N.¹ Cohen, A.²

65
- 0345491105
- Lee, C.; Yang, W.; Parr, R. G. Phys. Rev. B 1987, 37, 785-789
- (1987) Phys. Rev. B , vol.37 , pp. 785-789
- Lee, C.¹ Yang, W.² Parr, R.G.³

66
- 0003754095
- Ziesche, P. Eschrig, H. Akademie Verlag: Berlin
- Perdew, J. P. Electronic Structure of Solids 91; Ziesche, P.; Eschrig, H., Eds.; Akademie Verlag: Berlin, 1991; p 11
- (1991) Electronic Structure of Solids 91 , pp. 11
- Perdew, J.P.¹

67
- 4644265529
- Hammer, B.; Hansen, L.; Norskov, J. Phys. Rev. B 1999, 59, 7413-7421
- (1999) Phys. Rev. B , vol.59 , pp. 7413-7421
- Hammer, B.¹ Hansen, L.² Norskov, J.³

68
- 0035309319
- Boese, A. D.; Handy, N. C. J. Chem. Phys. 2000, 114, 5497-5503
- (2000) J. Chem. Phys , vol.114 , pp. 5497-5503
- Boese, A.D.¹ Handy, N.C.²

69
- 11244326290
- Adamo, C.; Barone, V. J. Chem. Phys. 1997, 108, 664-675
- (1997) J. Chem. Phys , vol.108 , pp. 664-675
- Adamo, C.¹ Barone, V.²

70
- 85029400214
- Zhang, Y.; Yang, W. Phys. Rev. Lett. 1997, 80, 890-890
- (1997) Phys. Rev. Lett , vol.80 , pp. 890-890
- Zhang, Y.¹ Yang, W.²

71
- 0242593713
- Tao, J.; Perdew, J. P.; Staroverov, V. N.; Scuseria, G. E. Phys. Rev. Lett. 2002, 91, 146401
- (2002) Phys. Rev. Lett , vol.91 , pp. 146401
- Tao, J.¹ Perdew, J.P.² Staroverov, V.N.³ Scuseria, G.E.⁴

72
- 0037799714
- Heyd, J.; Scuseria, G. E.; Ernzerhof, M. J. Chem. Phys. 2003, 118, 8207-8215
- (2003) J. Chem. Phys , vol.118 , pp. 8207-8215
- Heyd, J.¹ Scuseria, G.E.² Ernzerhof, M.³

73
- 0000189651
- Becke, A. D. J. Chem. Phys. 1992, 98, 5648-5652
- (1992) J. Chem. Phys , vol.98 , pp. 5648-5652
- Becke, A.D.¹

74
- 33751157732
- Stephens, P.; Devlin, F.; Chabalowski, C.; Frisch, M. J. J. Phys. Chem. 1993, 98, 11623-11627
- (1993) J. Phys. Chem , vol.98 , pp. 11623-11627
- Stephens, P.¹ Devlin, F.² Chabalowski, C.³ Frisch, M.J.⁴

75
- 3343011193
- Perdew, J. P.; Levy, M. Phys. Rev. Lett. 1983, 51, 1884-1887
- (1983) Phys. Rev. Lett , vol.51 , pp. 1884-1887
- Perdew, J.P.¹ Levy, M.²

76
- 0000053430
- Muscat, J.; Wander, A.; Harrison, N. Chem. Phys. Lett. 2001, 342, 397-401
- (2001) Chem. Phys. Lett , vol.342 , pp. 397-401
- Muscat, J.¹ Wander, A.² Harrison, N.³

77
- 3242884626
- Heyd, J.; Scuseria, G. E. J. Chem. Phys. 2003, 121, 1187-1192
- (2003) J. Chem. Phys , vol.121 , pp. 1187-1192
- Heyd, J.¹ Scuseria, G.E.²

78
- 43049085214
- Marsman, M.; Paier, J.; Stroppa, A.; Kresse, G. J. Phys.: Condens. Matter 2008, 20, 064201
- (2008) J. Phys.: Condens. Matter , vol.20 , pp. 064201
- Marsman, M.¹ Paier, J.² Stroppa, A.³ Kresse, G.⁴

79
- 46749147613
- Brothers, E. N.; Izmaylov, A. F.; Normand, J. O.; Barone, V.; Scuseria, G. E. J. Chem. Phys. 2008, 129, 011102
- (2008) J. Chem. Phys , vol.129 , pp. 011102
- Brothers, E.N.¹ Izmaylov, A.F.² Normand, J.O.³ Barone, V.⁴ Scuseria, G.E.⁵

80
- 47849116170
- Izmaylov, A. F.; Scuseria, G. E. J. Chem. Phys. 2008, 129, 034101
- (2008) J. Chem. Phys , vol.129 , pp. 034101
- Izmaylov, A.F.¹ Scuseria, G.E.²

81
- 60749099385
- Zhao, Y.; Truhlar, D. G. J. Chem. Phys. 2009, 130, 074103
- (2009) J. Chem. Phys , vol.130 , pp. 074103
- Zhao, Y.¹ Truhlar, D.G.²

82
- 70549084886
- Cramer, C. J.; Truhlar, D. G. Phys. Chem. Chem. Phys. 2009, 11, 10757
- (2009) Phys. Chem. Chem. Phys , vol.11 , pp. 10757
- Cramer, C.J.¹ Truhlar, D.G.²

83
- 84858649339
- Lucero, M. J.; Henderson, T. M.; Scuseria, G. E. J. Phys.: Condens. Matter 2012, 24, 145504
- (2012) J. Phys.: Condens. Matter , vol.24 , pp. 145504
- Lucero, M.J.¹ Henderson, T.M.² Scuseria, G.E.³

84
- 40149109196
- Chai, J.-D.; Head-Gordon, M. J. Chem. Phys. 2008, 128, 084106
- (2008) J. Chem. Phys , vol.128 , pp. 084106
- Chai, J.-D.¹ Head-Gordon, M.²

85
- 0000328386
- Gill, P. M. W.; Adamson, R. D.; Pople, J. A. Mol. Phys. 1996, 88, 1005-1009
- (1996) Mol. Phys , vol.88 , pp. 1005-1009
- Gill, P.M.W.¹ Adamson, R.D.² Pople, J.A.³

86
- 0031590109
- Leininger, T.; Stoll, H.; Werner, H.-J.; Savin, A. Chem. Phys. Lett. 1997, 275, 151-160
- (1997) Chem. Phys. Lett , vol.275 , pp. 151-160
- Leininger, T.¹ Stoll, H.² Werner, H.-J.³ Savin, A.⁴

87
- 84981601595
- Savin, A.; Flad, H. J. Int. J. Quantum Chem. 1995, 56, 327-332
- (1995) Int. J. Quantum Chem , vol.56 , pp. 327-332
- Savin, A.¹ Flad, H.J.²

88
- 50349093804
- Akinaga, Y.; Ten-no, S. Chem. Phys. Lett. 2008, 462, 348-351
- (2008) Chem. Phys. Lett , vol.462 , pp. 348-351
- Akinaga, Y.¹ Ten-No, S.²

89
- 84858321309
- Seth, M.; Ziegler, T. J. Chem. Theory Comput. 2012, 8, 901-907
- (2012) J. Chem. Theory Comput , vol.8 , pp. 901-907
- Seth, M.¹ Ziegler, T.²

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