SCOPUS 정보 검색 플랫폼 - 논문 보기

메뉴 건너뛰기

Journal of Molecular Structure: THEOCHEM

Volumn 388, Issue 1-3, 1996, Pages 209-219

TANGO-95. An electronic structure program for modeling chemisorption

(3) Patrito, E M a Paredes Olivera, P a Sellers, Harrell a

a SOUTH DAKOTA STATE UNIVERSITY (United States)

Author keywords

Ab initio; Chemisorption; DISCO; Relativistic effect; TANGO 95

Indexed keywords

EID: 0000688046 PISSN: 01661280 EISSN: None Source Type: Journal
DOI: 10.1016/s0166-1280(96)80034-0 Document Type: Article

Times cited : (10)

References (27)

1
- 0000732350
- L.E. McMurchie and E.R. Davidson, J. Comput. Phys., 26 (1978) 218.
- (1978) J. Comput. Phys. , vol.26 , pp. 218
- McMurchie, L.E.¹ Davidson, E.R.²

2
- 84986450150
- J. Almlöf, K. Faegri and K. Korsell, J. Comput. Chem., 3 (1982) 385.
- (1982) J. Comput. Chem. , vol.3 , pp. 385
- Almlöf, J.¹ Faegri, K.² Korsell, K.³

3
- 0041403310
- B. Brown, PC Mag., 15 (1996) 39.
- (1996) PC Mag. , vol.15 , pp. 39
- Brown, B.¹

4
- 0001045012
- P.M.W. Gill, Adv. Quantum Chem., 25 (1994) 141.
- (1994) Adv. Quantum Chem. , vol.25 , pp. 141
- Gill, P.M.W.¹

5
- 0001461294
- J.A. Pople and W.J. Hehre, J. Comput. Phys., 27 (1978) 161.
- (1978) J. Comput. Phys. , vol.27 , pp. 161
- Pople, J.A.¹ Hehre, W.J.²

6
- 36749119370
- M. Dupuis, J. Rys and H.F. King, J. Chem. Phys., 65 (1976) 111.
- (1976) J. Chem. Phys. , vol.65 , pp. 111
- Dupuis, M.¹ Rys, J.² King, H.F.³

7
- 0009569307
- H.F. King and M. Dupuis, J. Comput. Phys., 21 (1976) 44.
- (1976) J. Comput. Phys. , vol.21 , pp. 44
- King, H.F.¹ Dupuis, M.²

8
- 84986465499
- J. Rys, M. Dupuis and H.F. King, J. Comput. Chem., 4 (1983) 154.
- (1983) J. Comput. Chem. , vol.4 , pp. 154
- Rys, J.¹ Dupuis, M.² King, H.F.³

9
- 36549098458
- S. Obara and A. Saika, J. Chem. Phys., 84 (1986) 3963.
- (1986) J. Chem. Phys. , vol.84 , pp. 3963
- Obara, S.¹ Saika, A.²

10
- 0000000502
- M. Head-Gordon and J.A. Pople, J. Chem. Phys., 89 (1988) 5777.
- (1988) J. Chem. Phys. , vol.89 , pp. 5777
- Head-Gordon, M.¹ Pople, J.A.²

11
- 5244380814
- (a) H. Sellers, J. Phys. Chem., 94 (1990) 8329;
- (1990) J. Phys. Chem. , vol.94 , pp. 8329
- Sellers, H.¹

12
- 0000912529
- (b) H. Sellers, A. Ulman, Y. Shnidman and J.E. Eilers, J. Am. Chem. Soc., 115 (1993) 9389.
- (1993) J. Am. Chem. Soc. , vol.115 , pp. 9389
- Sellers, H.¹ Ulman, A.² Shnidman, Y.³ Eilers, J.E.⁴

13
- 84990639646
- D. Hegarty and G. Van der Velde. Int. J. Quantum Chem., 23 (1983) 1135.
- (1983) Int. J. Quantum Chem. , vol.23 , pp. 1135
- Hegarty, D.¹ Van Der Velde, G.²

14
- 0042906418
- release 2, Waterloo Maple Inc., Waterloo, Ont., Canada
- Maple V, release 2, Waterloo Maple Inc., Waterloo, Ont., Canada.
- Maple, V.¹

15
- 4243539377
- R. Ahlrichs, M. Bär, M. Häser, H. Horn and C. Kölmel, Chem. Phys. Lett., 162 (1989) 165.
- (1989) Chem. Phys. Lett. , vol.162 , pp. 165
- Ahlrichs, R.¹ Bär, M.² Häser, M.³ Horn, H.⁴ Kölmel, C.⁵

16
- 0001099217
- Y. Sakai and S. Huzinaga, J. Chem. Phys., 76 (1982) 2537.
- (1982) J. Chem. Phys. , vol.76 , pp. 2537
- Sakai, Y.¹ Huzinaga, S.²

17
- 0042405675
- Y. Sakai and S. Huzinaga, J. Chem. Phys., 76 (1982) 2552.
- (1982) J. Chem. Phys. , vol.76 , pp. 2552
- Sakai, Y.¹ Huzinaga, S.²

18
- 0000383501
- A. Korminicki, K. Ishida, K. Morokuma, R. Ditchfield and M. Conrad, Chem. Phys. Lett., 45 (1977) 595.
- (1977) Chem. Phys. Lett. , vol.45 , pp. 595
- Korminicki, A.¹ Ishida, K.² Morokuma, K.³ Ditchfield, R.⁴ Conrad, M.⁵

19
- 0039781074
- H. Sellers, Chem. Phys. Lett., 178 (1991) 351.
- (1991) Chem. Phys. Lett. , vol.178 , pp. 351
- Sellers, H.¹

20
- 84990711384
- H. Sellers, Int. J. Quantum Chem., 45 (1993) 31.
- (1993) Int. J. Quantum Chem. , vol.45 , pp. 31
- Sellers, H.¹

21
- 84986524957
- P. Pulay, Chem. Phys. Lett., 73 (1980) 393.
- (1980) Chem. Phys. Lett. , vol.73 , pp. 393
- Pulay, P.¹

22
- 0000065149
- H. Sellers, Chem. Phys. Lett., 180 (1991) 461.
- (1991) Chem. Phys. Lett. , vol.180 , pp. 461
- Sellers, H.¹

23
- 0002319063
- S. Saebø and J. Almlöf, Chem. Phys. Lett., 154 (1989) 83.
- (1989) Chem. Phys. Lett. , vol.154 , pp. 83
- Saebø, S.¹ Almlöf, J.²

24
- 84987141404
- S. Saebø, Int. J. Quantum Chem., 42 (1992) 217.
- (1992) Int. J. Quantum Chem. , vol.42 , pp. 217
- Saebø, S.¹

25
- 34250126673
- P. Pulay and S. Saebø, Theoret. Chim. Acta, 69 (1986) 357.
- (1986) Theoret. Chim. Acta , vol.69 , pp. 357
- Pulay, P.¹ Saebø, S.²

26
- 36549103461
- S. Saebø and P. Pulay, J. Chem. Phys., 86 (1987) 914.
- (1987) J. Chem. Phys. , vol.86 , pp. 914
- Saebø, S.¹ Pulay, P.²

27
- 0000485335
- S. Saebø and P. Pulay, J. Chem. Phys., 88 (1988) 1884.
- (1988) J. Chem. Phys. , vol.88 , pp. 1884
- Saebø, S.¹ Pulay, P.²

* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.