SCOPUS 정보 검색 플랫폼 - 논문 보기

메뉴 건너뛰기

Theoretical Chemistry Accounts

Volumn 102, Issue 1-6, 1999, Pages 127-133

The spin-forbidden reaction CH(2Π) + N2 → HCN + N(4S) revisited I. Ab initio study of the potential energy surfaces

(2) Cui, Qiang a Morokuma, Keiji a

a EMORY UNIVERSITY (United States)

Author keywords

Nonadiabatic processes; Potential energy surfaces

Indexed keywords

EID: 0033450088 PISSN: 1432881X EISSN: None Source Type: Journal
DOI: 10.1007/s002140050482 Document Type: Article

Times cited : (31)

References (31)

1
- 0024932917
- Miller JA, Bowman CT (1989) Prog Energy Combust Sci 15: 287
- (1989) Prog Energy Combust Sci , vol.15 , pp. 287
- Miller, J.A.¹ Bowman, C.T.²

2
- 0039484755
- Elsevier, New York
- Bozzelli JW, Karim MHU, Dean AM (1993) Proceedings of the 6th Toyota Conference on Turbulence and Molecular Processes in Combustion. Elsevier, New York
- (1993) Proceedings of the 6th Toyota Conference on Turbulence and Molecular Processes in Combustion
- Bozzelli, J.W.¹ Karim, M.H.U.² Dean, A.M.³

3
- 84959175359
- (a) Manaa MR, Yarkony DR (1991) J Chem Phys 95: 1808;
- (1991) J Chem Phys , vol.95 , pp. 1808
- Manaa, M.R.¹ Yarkony, D.R.²

4
- 33748610098
- (b) Manaa MR, Yarkony DR (1991) Chem Phys Lett 188: 352
- (1991) Chem Phys Lett , vol.188 , pp. 352
- Manaa, M.R.¹ Yarkony, D.R.²

5
- 0001366136
- Martin JML, Taylor PR (1993) Chem Phys Lett 209: 143
- (1993) Chem Phys Lett , vol.209 , pp. 143
- Martin, J.M.L.¹ Taylor, P.R.²

6
- 0000285008
- Walch SP (1993) Chem Phys Lett 208: 214
- (1993) Chem Phys Lett , vol.208 , pp. 214
- Walch, S.P.¹

7
- 0001197696
- Seideman T, Walch SP (1994) J Chem Phys 101: 3656
- (1994) J Chem Phys , vol.101 , pp. 3656
- Seideman, T.¹ Walch, S.P.²

8
- 0000056643
- Seideman T (1994) J Chem Phys 101: 3662
- (1994) J Chem Phys , vol.101 , pp. 3662
- Seideman, T.¹

9
- 4243842286
- submitted
- Cui Q, Morokuma K, Bowman JM, Klippenstein SJ J Chem Phys (submitted)
- J Chem Phys
- Cui, Q.¹ Morokuma, K.² Bowman, J.M.³ Klippenstein, S.J.⁴

10
- 33845503800
- Miller WH (1976) J Chem Phys 65: 2216
- (1976) J Chem Phys , vol.65 , pp. 2216
- Miller, W.H.¹

11
- 4243553426
- (a) Becke AD (1988) Phys Rev A 38: 3098;
- (1988) Phys Rev A , vol.38 , pp. 3098
- Becke, A.D.¹

12
- 0345491105
- (b) Lee C, Yang W, Parr RG (1988) Phys Rev B 37: 785;
- (1988) Phys Rev B , vol.37 , pp. 785
- Lee, C.¹ Yang, W.² Parr, R.G.³

13
- 0000189651
- (c) Becke AD (1993) J Chem Phys 98: 5648
- (1993) J Chem Phys , vol.98 , pp. 5648
- Becke, A.D.¹

14
- 26844534384
- Krishnan R, Binkley JS, Seeger R, Pople JA (1980) J Chem Phys 72: 650
- (1980) J Chem Phys , vol.72 , pp. 650
- Krishnan, R.¹ Binkley, J.S.² Seeger, R.³ Pople, J.A.⁴

15
- 33751044609
- (a) Fukui K (1981) Acc Chem Res 14: 363;
- (1981) Acc Chem Res , vol.14 , pp. 363
- Fukui, K.¹

16
- 0011713208
- (b) Kato S, Morokuma K (1980) J Chem Phys 73: 3900
- (1980) J Chem Phys , vol.73 , pp. 3900
- Kato, S.¹ Morokuma, K.²

17
- 0002445770
- Werner H-J (1987) Adv Chem Phys 79: 1
- (1987) Adv Chem Phys , vol.79 , pp. 1
- Werner, H.-J.¹

18
- 0003418036
- Yarkony DR (ed) World Scientific, Singapore
- Bartlett RJ (1995) In: Yarkony DR (ed) Modern electronic structure theory. World Scientific, Singapore
- (1995) Modern Electronic Structure Theory
- Bartlett, R.J.¹

19
- 0003418036
- Yarkony DR (ed) World Scientific, Singapore
- Anderson K, Roos B (1995) In: Yarkony DR (ed) Modern electronic structure theory. World Scientific, Singapore
- (1995) Modern Electronic Structure Theory
- Anderson, K.¹ Roos, B.²

20
- 33746614482
- (a) Dunning TH Jr (1989) J Chem Phys 90: 1007:
- (1989) J Chem Phys , vol.90 , pp. 1007
- Dunning T.H., Jr.¹

21
- 4143095330
- (b) Kendall RA, Dunning TH Jr, Harrison RJ (1992) J Chem Phys 96: 6796
- (1992) J Chem Phys , vol.96 , pp. 6796
- Kendall, R.A.¹ Dunning T.H., Jr.² Harrison, R.J.³

22
- 36449008175
- Mebel AM, Morokuma K, Lin MC (1995) J Chem Phys 103: 7414
- (1995) J Chem Phys , vol.103 , pp. 7414
- Mebel, A.M.¹ Morokuma, K.² Lin, M.C.³

23
- 0001298982
- Koseki S, Schimidt MW, Gordon MS (1992) J Phys Chem 96: 10768
- (1992) J Phys Chem , vol.96 , pp. 10768
- Koseki, S.¹ Schimidt, M.W.² Gordon, M.S.³

24
- 0003662634
- Pittsburg
- Frisch MJ, Trucks GW, Schlegel HB, Gill PMW, Johnson BG, Robb MA, Cheeseman JR, Keith T, Petersson GA, Montgomery JA, Raghavachari K, Al-Laham MA, Zakrzewski VG, Ortiz JV, Foresman JB, Peng CY, Ayala PY, Chen W, Wong MW, Andres JL, Replogle ES, Gomperts R, Martin RL, Fox DJ, Binkley JS, Defrees DJ, Baker J, Stewart JP, Head-Gordon M, Gonzalez C, Pople JA (1995) Gaussian, Gaussian 94, revision D.3. Pittsburg
- (1995) Gaussian, Gaussian 94, Revision D.3
- Frisch, M.J.¹ Trucks, G.W.² Schlegel, H.B.³ Gill, P.M.W.⁴ Johnson, B.G.⁵ Robb, M.A.⁶ Cheeseman, J.R.⁷ Keith, T.⁸ Petersson, G.A.⁹ Montgomery, J.A.¹⁰ Raghavachari, K.¹¹ Al-Laham, M.A.¹² Zakrzewski, V.G.¹³ Ortiz, J.V.¹⁴ Foresman, J.B.¹⁵ Peng, C.Y.¹⁶ Ayala, P.Y.¹⁷ Chen, W.¹⁸ Wong, M.W.¹⁹ Andres, J.L.²⁰ more..

25
- 0040940123
- University of Birmingham, Birmingham, UK
- Knowles PJ, Werner H-J, Molpro96.4. University of Birmingham, Birmingham, UK
- Molpro96.4
- Knowles, P.J.¹ Werner, H.-J.²

26
- 0004040381
- Florida State University
- Stanton JF, Gauss J, Lauderdale WJ, Watts JD, Bartlett RJ ACES-II. Florida State University
- ACES-II
- Stanton, J.F.¹ Gauss, J.² Lauderdale, W.J.³ Watts, J.D.⁴ Bartlett, R.J.⁵

27
- 84893169025
- Schmidt MW, Baldridge KK, Boatz JA, Elbert ST, Gordon MS, Jensen JH, Koseki S, Matsunaga N, Nguyen KA, Su SJ, Windus TL, Dupuis M, Montgomery JS (1993) J Comput Chem 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.J.¹⁰ Windus, T.L.¹¹ Dupuis, M.¹² Montgomery, J.S.¹³

28
- 0000141011
- (a) Havriliak SJ, Yarkony DR (1985) J Chem Phys 83: 1168;
- (1985) J Chem Phys , vol.83 , pp. 1168
- Havriliak, S.J.¹ Yarkony, D.R.²

29
- 36549090604
- (b) Yarkony DR (1986) J Chem Phys 84: 2075
- (1986) J Chem Phys , vol.84 , pp. 2075
- Yarkony, D.R.¹

30
- 0000491428
- Baboul AB, Schlegel HB (1997) J Chem Phys 107: 9413
- (1997) J Chem Phys , vol.107 , pp. 9413
- Baboul, A.B.¹ Schlegel, H.B.²

31
- 0000272650
- Davidson ER (1998) J Comput Chem 69: 241
- (1998) J Comput Chem , vol.69 , pp. 241
- Davidson, E.R.¹

* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.