SCOPUS 정보 검색 플랫폼

International Journal of Quantum Chemistry

Volumn 113, Issue 9, 2013, Pages 1401-1408

An orbital localization criterion based on the topological analysis of the electron localization function

(5) Oña, Ofelia B a Alcoba, Diego R b Tiznado, William c Torre, Alicia d Lain, Luis d

a INSTITUTO DE INVESTIGACIONES FISICOQUÍMICAS TEÓRICAS Y APLICADAS INIFTA (Argentina)

b UNIVERSIDAD DE BUENOS AIRES (Argentina)

c UNIVERSIDAD ANDRÉS BELLO (Chile)

d UNIVERSITY OF THE BASQUE COUNTRY UPV EHU (Spain)

Author keywords

electron localization function; localized molecular orbital

Indexed keywords

ELECTRON LOCALIZATION FUNCTION; LOCALIZATION ALGORITHM; LOCALIZATION INDEX; LOCALIZATION PROCEDURE; LOCALIZED MOLECULAR ORBITALS; MOLECULAR SYSTEMS; ORBITALS; TOPOLOGICAL ANALYSIS;

CHEMICAL ANALYSIS; MOLECULAR ORBITALS;

TOPOLOGY;

EID: 84875382353 PISSN: 00207608 EISSN: 1097461X Source Type: Journal
DOI: 10.1002/qua.24332 Document Type: Article

Times cited : (12)

References (25)

1
- 0011085390
- J. W. Linnett, J. Am. Chem. Soc. 1961, 83, 2643.
- (1961) J. Am. Chem. Soc. , vol.83 , pp. 2643
- Linnett, J.W.¹

2
- 3042691933
- J. M. Foster, S. F. Boys, Rev. Mod. Phys. 1960, 32, 300.
- (1960) Rev. Mod. Phys. , vol.32 , pp. 300
- Foster, J.M.¹ Boys, S.F.²

3
- 85081455419
- C. Edmiston, K. Ruedenberg, J. Chem. Phys. 1965, S97, 43.
- (1965) J. Chem. Phys. , vol.97 S , pp. 43
- Edmiston, C.¹ Ruedenberg, K.²

4
- 0000815839
- W. von Niessen, J. Chem. Phys. 1972, 56, 4290.
- (1972) J. Chem. Phys. , vol.56 , pp. 4290
- Von Niessen, W.¹

5
- 3142753249
- J. Pipek, P. G. Mezey, J. Chem. Phys. 1989, 90, 4916.
- (1989) J. Chem. Phys. , vol.90 , pp. 4916
- Pipek, J.¹ Mezey, P.G.²

6
- 0007629370
- J. Cioslowski, J. Math. Chem. 1991, 8, 169.
- (1991) J. Math. Chem. , vol.8 , pp. 169
- Cioslowski, J.¹

7
- 84987102159
- J. Cioslowski, Int. J. Quantum Chem. 1990, S24, 15.
- (1990) Int. J. Quantum Chem. , vol.24 S , pp. 15
- Cioslowski, J.¹

8
- 33645325936
- D. R. Alcoba, L. Lain, A. Torre, R. C. Bochicchio, J. Comput. Chem. 2006, 27, 596.
- (2006) J. Comput. Chem. , vol.27 , pp. 596
- Alcoba, D.R.¹ Lain, L.² Torre, A.³ Bochicchio, R.C.⁴

9
- 18244371650
- D. R. Alcoba, L. Lain, A. Torre, R. C. Bochicchio, Chem. Phys. Lett. 2005, 407, 379.
- (2005) Chem. Phys. Lett. , vol.407 , pp. 379
- Alcoba, D.R.¹ Lain, L.² Torre, A.³ Bochicchio, R.C.⁴

10
- 33746053840
- D. R. Alcoba, L. Lain, A. Torre, R. C. Bochicchio, Chem. Phys. Lett. 2006, 426, 426.
- (2006) Chem. Phys. Lett. , vol.426 , pp. 426
- Alcoba, D.R.¹ Lain, L.² Torre, A.³ Bochicchio, R.C.⁴

11
- 23844496077
- A. Torre, D. R. Alcoba, L. Lain, R. C. Bochicchio, J. Phys. Chem. A 2005, 109, 6587.
- (2005) J. Phys. Chem. A , vol.109 , pp. 6587
- Torre, A.¹ Alcoba, D.R.² Lain, L.³ Bochicchio, R.C.⁴

12
- 0942301227
- B. Silvi, Phys. Chem. Chem. Phys. 2004, 6, 256.
- (2004) Phys. Chem. Chem. Phys. , vol.6 , pp. 256
- Silvi, B.¹

13
- 0030166214
- A. Savin, B. Silvi, F. Colonna, Can. J. Chem. 1996, 74, 1088.
- (1996) Can. J. Chem. , vol.74 , pp. 1088
- Savin, A.¹ Silvi, B.² Colonna, F.³

14
- 36549100412
- A. D. Becke, K. E. Edgecombe, J. Chem. Phys. 1990, 92, 5397.
- (1990) J. Chem. Phys. , vol.92 , pp. 5397
- Becke, A.D.¹ Edgecombe, K.E.²

15
- 0027946619
- B. Silvi, A. Savin, Nature 1994, 371, 683.
- (1994) Nature , vol.371 , pp. 683
- Silvi, B.¹ Savin, A.²

16
- 0037341415
- E. Chamorro, P. Fuentealba, A. Savin, J. Comput. Chem. 2003, 24, 496.
- (2003) J. Comput. Chem. , vol.24 , pp. 496
- Chamorro, E.¹ Fuentealba, P.² Savin, A.³

17
- 27844549784
- P. W. Ayers, J. Chem. Sci. 2005, 117, 441.
- (2005) J. Chem. Sci. , vol.117 , pp. 441
- Ayers, P.W.¹

18
- 0032170030
- S. Noury, F. Colonna, A. Savin, B. Silvi, J. Mol. Struct. (Theochem) 1998, 450, 59.
- (1998) J. Mol. Struct. (Theochem) , vol.450 , pp. 59
- Noury, S.¹ Colonna, F.² Savin, A.³ Silvi, B.⁴

19
- 23644451929
- A. Savin, J. Mol. Struct. (Theochem) 2005, 727, 127.
- (2005) J. Mol. Struct. (Theochem) , vol.727 , pp. 127
- Savin, A.¹

20
- 0007899114
- J. M. Leonard, W. L. Luken, Theor. Chim. Acta 1982, 62, 107.
- (1982) Theor. Chim. Acta , vol.62 , pp. 107
- Leonard, J.M.¹ Luken, W.L.²

21
- 7544236830
- C. Edmiston, K. Ruedenberg, Rev. Mod. Phys. 1963, 35, 457.
- (1963) Rev. Mod. Phys. , vol.35 , pp. 457
- Edmiston, C.¹ Ruedenberg, K.²

22
- 84893169025
- 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. Su, T. L. Windus, M. Dupuis, J. A. Montgomery, J. Comput. Chem. 1993, 14, 1347.
- (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.¹⁰ Windus, T.L.¹¹ Dupuis, M.¹² Montgomery, J.A.¹³

23
- 0004176862
- S. Noury, X. Krokidis, F. Fuster, B. Silvi, TopMod Package, 1997.
- (1997) TopMod Package
- Noury, S.¹ Krokidis, X.² Fuster, F.³ Silvi, B.⁴

24
- 33748225339
- A. Savin, A. D. Becke, J. Flad, R. Nesper, H. Preuss, H. G. von Schnering, Angew. Chem. Int. Ed. Engl. 1991, 30, 409.
- (1991) Angew. Chem. Int. Ed. Engl. , vol.30 , pp. 409
- Savin, A.¹ Becke, A.D.² Flad, J.³ Nesper, R.⁴ Preuss, H.⁵ Von Schnering, H.G.⁶

25
- 0001292101
- J. Cioslowski, S. T. Mixon, J. Am. Chem. Soc. 1991, 113, 4142.
- (1991) J. Am. Chem. Soc. , vol.113 , pp. 4142
- Cioslowski, J.¹ Mixon, S.T.²

* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.