SCOPUS 정보 검색 플랫폼

Journal of Chemical Physics

Volumn 115, Issue 3, 2001, Pages 1243-1250

New inversion coordinate for ammonia: Application to a CCSD(T) bidimensional potential energy surface

(3) Pesonen, Janne a Miani, Andrea a Halonen, Lauri b

a UNIVERSITY OF HELSINKI (Finland)

b UNIVERSITY OF COLORADO (United States)

Author keywords

[No Author keywords available]

Indexed keywords

EIGENVALUES AND EIGENFUNCTIONS; ELECTRONIC STRUCTURE; KINEMATICS; MATHEMATICAL OPERATORS; MOLECULES; PERTURBATION TECHNIQUES; POTENTIAL ENERGY; PROBABILITY DENSITY FUNCTION; SET THEORY; SPECTROSCOPIC ANALYSIS; TENSORS;

POTENTIAL ENERGY SURFACES (PES);

AMMONIA;

EID: 0035878669 PISSN: 00219606 EISSN: None Source Type: Journal
DOI: 10.1063/1.1379752 Document Type: Article

Times cited : (52)

References (50)

1
- 37049079750
- (1988) J. Chem. Soc., Faraday Trans. 2 , vol.84 , pp. 1389
- Lehmann, K.K.¹ Coy, S.L.²

2
- 0002619155
- (1989) Spectrochim. Acta, Part A , vol.45 , pp. 47
- Coy, S.L.¹ Lehmann, K.K.²

3
- 0001459930
- (1997) J. Phys. Chem. A , vol.101 , pp. 3143
- Rush, D.¹ Wiberg, K.²

4
- 21344494571
- (1993) Chem. Phys. , vol.178 , pp. 189
- Wormer, P.¹ Olthof, E.² Engeln, R.³ Reuss, J.⁴

5
- 0021630882
- (1984) Can. J. Phys. , vol.62 , pp. 1801
- Bunker, P.¹ Kraemer, W.² Špirko, V.³

6
- 84990648087
- (1989) Int. J. Quantum Chem., Quantum Chem. Syrup. , vol.23 , pp. 355
- Campoy, G.¹ Palma, A.² Sandoval, L.³

7
- 0004527235
- (2001) Chem. Phys. Lett. , vol.333 , pp. 391
- Halpern, A.M.¹ Glendening, E.D.²

8
- 36549103426
- (1987) J. Chem. Phys. , vol.86 , pp. 6677
- Rosmus, P.¹ Botschwina, P.² Werner, H.-J.³ Vaida, V.⁴ Engelking, P.C.⁵ McCarthy, M.I.⁶

9
- 0000147890
- (1989) J. Mol. Spectrosc. , vol.133 , pp. 331
- Špirko, V.¹ Kraemer, W.P.²

10
- 0002670091
- (1983) J. Mol. Spectrosc. , vol.101 , pp. 30
- Špirko, V.¹

11
- 0004503595
- (1996) J. Mol. Struct. , vol.376 , pp. 437
- East, A.¹ Radom, L.²

12
- 0006244148
- (1989) Chem. Phys. Lett. , vol.157 , pp. 479
- Raghavachari, K.¹ Trucks, G.W.² Pople, J.A.³ Head-Gurdon, M.⁴

13
- 36448998726
- (1996) J. Chem. Phys. , vol.10 , pp. 2589
- Martin, J.M.L.¹ Lee, T.J.² Taylor, P.R.³ François, J.⁴

14
- 36449001545
- (1995) J. Chem. Phys. , vol.102 , pp. 254
- Lee, T.J.¹ Martin, J.M.L.² Taylor, P.R.³

15
- 36449009104
- (1992) J. Chem. Phys. , vol.97 , pp. 8361
- Martin, J.¹ Lee, T.² Taylor, P.³

16
- 0000411866
- (1995) J. Chem. Phys. , vol.103 , pp. 6861
- Kauppi, E.¹ Halonen, L.²

17
- 0000156083
- (1999) Mol. Phys. , vol.96 , pp. 477
- Handy, N.C.¹ Carter, S.² Colwell, S.M.³

18
- 0034224637
- (2000) J. Chem. Phys. , vol.113 , pp. 1329
- Luckhaus, D.¹

19
- 0000090201
- (1999) J. Chem. Phys. , vol.111 , pp. 7225
- Gatti, F.¹

20
- 0000946396
- (1999) J. Chem. Phys. , vol.111 , pp. 7236
- Gatti, F.¹ Iung, C.² Leforestier, C.³

21
- 33748606401
- (1997) J. Chem. Soc., Faraday Trans. , vol.93 , pp. 801
- Aquilanti, V.¹ Cavalli, S.²

22
- 0345491105
- (1988) Phys. Rev. B , vol.37 , pp. 785
- Lee, C.¹ Yang, W.² Parr, R.³

23
- 0000189651
- (1993) J. Chem. Phys. , vol.98 , pp. 5648
- Becke, A.¹

24
- 0000315164
- (1998) Chem. Phys. Lett. , vol.296 , pp. 111
- Aquino, N.¹ Campoy, G.² Yee-Madeira, H.³

25
- 0004118197
- NRC Research, Ottawa
- (1998) Molecular Symmetry and Spectroscopy, 2nd ed.
- Bunker, P.R.¹ Jensen, P.²

26
- 0003501177
- Wiley, New York
- (1990) Chemical Applications of Group Theory, 3rd ed.
- Cotton, F.A.¹

27
- 33749420348
- (1972) Mol. Phys. , vol.24 , pp. 1265
- Hoy, A.R.¹ Strey, G.² Mills, I.M.³

28
- 0031559554
- (1997) J. Chem. Phys. , vol.107 , pp. 1717
- Pak, Y.¹ Sibert, E.L.² Woods, R.C.³

29
- 0001218803
- (2000) J. Chem. Phys. , vol.112 , pp. 3121
- Pesonen, J.¹

30
- 0004003691
- McGraw-Hill, New York
- (1955) Molecular Vibrations
- Wilson, E.B.¹ Decius, J.C.² Cross, P.C.³

31
- 36149004990
- (1928) Phys. Rev. , vol.32 , pp. 812
- Podolsky, B.¹

32
- 9344221361
- (1972) Int. J. Theor. Phys. , vol.6 , pp. 31
- Gruber, G.¹

33
- 0000663960
- (1985) Mol. Phys. , vol.55 , pp. 1287
- Nauts, A.¹ Chapuisat, X.²

34
- 0004529765
- note

35
- 0003970164
- Van Nostrand, Princeton
- (1956) The Mathematics of Physics and Chemistry
- Margenau, H.¹ Murphy, G.M.²

36
- 36449005067
- (1995) J. Chem. Phys. , vol.102 , pp. 3945
- Lukka, T.¹

37
- 0004492920
- Springer, New York
- (1976) Numerical Data and Functional Relationships in Science and Technology , vol.2 , Issue.2-7
- Landolt-Börnstein¹

38
- 33746614482
- (1989) J. Chem. Phys. , vol.90 , pp. 1007
- Dunning T.H., Jr.¹

39
- 4143095330
- (1992) J. Chem. Phys. , vol.96 , pp. 6796
- Kendall, R.A.¹ Dunning T.H., Jr.² Harrison, R.J.³

40
- 0004133516
- Gaussian, Inc., Pittsburgh, PA
- (1998) GAUSSIAN 98, Revision A.7
- Frisch, M.J.¹ Trucks, G.W.² Schlegel, H.B.³

41
- 0004149831
- Wolfram Media/Cambridge University Press, Cambridge, MA
- (1999) The Mathematica Book, 4th ed.
- Wolfram, S.¹

42
- 0004161838
- Cambridge University Press, Cambridge, MA
- (1992) Numerical Recipes in Fortran77: The Art of Scientific Computing
- Press, W.H.¹ Teukolsky, S.A.² Vetterling, W.T.³ Flannery, B.P.⁴

43
- 0004475589
- for details on the numerical method

44
- 12144268141
- (1929) Phys. Rev. , vol.34 , pp. 57
- Morse, P.M.¹

45
- 0000040116
- (1989) J. Phys. B , vol.21 , pp. 2863
- Matsumoto, A.¹

46
- 0032540080
- (1998) J. Phys. A , vol.31 , pp. 3461
- Bancewicz, M.¹

47
- 33751553168
- (1990) J. Phys. Chem. , vol.94 , pp. 5779
- Kauppi, E.¹ Halonen, L.²

48
- 0000228810
- (1985) J. Comput. Appl. Math. , vol.12-13 , pp. 119
- Mori, M.¹

49
- 0004541726
- the Gains software repository

50
- 0001470765
- (1992) Can. J. Chem. , vol.70 , pp. 560
- Godbout, N.¹ Salahub, D.R.² Andzelm, J.³ Wimmer, E.⁴

* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.