SCOPUS 정보 검색 플랫폼

Journal of Chemical Physics

Volumn 109, Issue 17, 1998, Pages 7286-7299

Ab initio and regularized force fields of haloethanes: CH3CH2Cl, CH3CHCl2, CH3CF2Cl, and CH3CFCl2

(3) Kuramshina, G M a Weinhold, F a Pentin, Yu A b

a UNIVERSITY OF WISCONSIN MADISON (United States)

b MOSCOW STATE UNIVERSITY (Russian Federation)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0001093654 PISSN: 00219606 EISSN: None Source Type: Journal
DOI: 10.1063/1.477404 Document Type: Article

Times cited : (20)

References (58)

1
- 36449002799
- G. M. Kuramshina, F. Weinhold, I. V. Kochikov, A. G. Yagola, and Yu. A. Pentin, J. Chem. Phys. 100, 1414 (1993).
- (1993) J. Chem. Phys. , vol.100 , pp. 1414
- Kuramshina, G.M.¹ Weinhold, F.² Kochikov, I.V.³ Yagola, A.G.⁴ Pentin Yu., A.⁵

2
- 21344475965
- G. M. Kuramshina, F. Weinhold, I. V. Kochikov, A. G. Yagola, and Yu. A. Pentin, Russ. J. Phys. Chem. 68, 358 (1994).
- (1994) Russ. J. Phys. Chem. , vol.68 , pp. 358
- Kuramshina, G.M.¹ Weinhold, F.² Kochikov, I.V.³ Yagola, A.G.⁴ Pentin Yu., A.⁵

3
- 0345682045
- G. M. Kuramshina and Yu. A. Pentin, J. Chem. Thermodyn. 11, 1115 (1979).
- (1979) J. Chem. Thermodyn. , vol.11 , pp. 1115
- Kuramshina, G.M.¹ Pentin Yu., A.²

4
- 0007845189
- in edited by P. A. Akishin Moscow University, Moscow
- G. M. Kuramshina and Yu. A. Pentin, in Structure of Molecules, edited by P. A. Akishin (Moscow University, Moscow, 1986), pp. 58-77.
- (1986) Structure of Molecules , pp. 58-77
- Kuramshina, G.M.¹ Pentin Yu., A.²

5
- 0038658139
- I. V. Kochikov, G. M. Kuramshina, S. V. Syn'ko, and Yu. A. Pentin, J. Mol. Struct. 172, 299 (1988).
- (1988) J. Mol. Struct. , vol.172 , pp. 299
- Kochikov, I.V.¹ Kuramshina, G.M.² Syn'ko, S.V.³ Pentin Yu., A.⁴

6
- 21944448745
- V. M. Senyavin, G. M. Kuramshina, and Yu. A. Pentin, Russ. J. Phys. Chem. 66, 191 (1992).
- (1992) Russ. J. Phys. Chem. , vol.66 , pp. 191
- Senyavin, V.M.¹ Kuramshina, G.M.² Pentin Yu., A.³

7
- 21944435855
- V. M. Senyavin, S. B. Osin, G. M. Kuramshina, and Yu. A. Pentin, Russ. J. Phys. Chem. 67, 638 (1993).
- (1993) Russ. J. Phys. Chem. , vol.67 , pp. 638
- Senyavin, V.M.¹ Osin, S.B.² Kuramshina, G.M.³ Pentin Yu., A.⁴

8
- 21944443034
- I. V. Kochikov, G. M. Kuramshina, Yu. A. Pentin, and A. G. Yagola, Dokl. Acad. Nauk SSSR 261, 1104 (1981).
- (1981) Dokl. Acad. Nauk SSSR , vol.261 , pp. 1104
- Kochikov, I.V.¹ Kuramshina, G.M.² Pentin Yu., A.³ Yagola, A.G.⁴

9
- 21944436555
- I. V. Kochikov, G. M. Kuramshina, Yu. A. Pentin, and A. G. Yagola, Dokl. Acad. Nauk SSSR 283, 850 (1985).
- (1985) Dokl. Acad. Nauk SSSR , vol.283 , pp. 850
- Kochikov, I.V.¹ Kuramshina, G.M.² Pentin Yu., A.³ Yagola, A.G.⁴

10
- 0002523713
- I. V. Kochikov, G. M. Kuramshina, and A. G. Yagola, U.S.S.R. Comput. Math. Math. Phys. 27, 33 (1987).
- (1987) U.S.S.R. Comput. Math. Math. Phys. , vol.27 , pp. 33
- Kochikov, I.V.¹ Kuramshina, G.M.² Yagola, A.G.³

11
- 21944451163
- G. M. Kuramshina and Yu. A. Pentin, Russ. J. Phys. Chem. 67, 95 (1993).
- (1993) Russ. J. Phys. Chem. , vol.67 , pp. 95
- Kuramshina, G.M.¹ Pentin Yu., A.²

12
- 85009264164
- I. V. Kochikov, G. M. Kuramshina, and Ya. A. Pentin, Russ. J. Phys. Chem. 61, 865 (1987).
- (1987) Russ. J. Phys. Chem. , vol.61 , pp. 865
- Kochikov, I.V.¹ Kuramshina, G.M.² Pentin Ya., A.³

13
- 21944456335
- I. V. Kochikov, G. M. Kuramshina, Yu. A. Pentin, and A. G. Yagola, J. Mol. Struct. 292, 113 (1993).
- (1993) J. Mol. Struct. , vol.292 , pp. 113
- Kochikov, I.V.¹ Kuramshina, G.M.² Pentin Yu., A.³ Yagola, A.G.⁴

14
- 0003665434
- Nauka, Moscow
- A. V. Goncharskii, A. M. Cherepaschuk, and A. G. Yagola, Ill-Posed Problems in Astrophysics (Nauka, Moscow, 1985).
- (1985) Ill-Posed Problems in Astrophysics
- Goncharskii, A.V.¹ Cherepaschuk, A.M.² Yagola, A.G.³

15
- 0003686249
- Nauka, Moscow
- A. N. Tikhonov, A. V. Goncharskii, V. V. Stepanov, and A. G. Yagola, Numerical Methods for Solving of Ill-Posed Problems (Nauka, Moscow, 1990).
- (1990) Numerical Methods for Solving of Ill-Posed Problems
- Tikhonov, A.N.¹ Goncharskii, A.V.² Stepanov, V.V.³ Yagola, A.G.⁴

16
- 0344778587
- Moscow University, Moscow
- I. V. Kochikov, G. M. Kuramshina, Yu. A. Pentin, and A. G. Yagola, Inverse Problems in Vibrational Spectroscopy (Moscow University, Moscow, 1993).
- (1993) Inverse Problems in Vibrational Spectroscopy
- Kochikov, I.V.¹ Kuramshina, G.M.² Pentin Yu., A.³ Yagola, A.G.⁴

17
- 21944447807
- A. S. Dostavalova, I. V. Kochikov, G. M. Kuramshina, and A. G. Yagola, Dokl. Acad. Nauk SSSR 315, 1368 (1990).
- (1990) Dokl. Acad. Nauk SSSR , vol.315 , pp. 1368
- Dostavalova, A.S.¹ Kochikov, I.V.² Kuramshina, G.M.³ Yagola, A.G.⁴

18
- 0003889405
- Nauka, Moscow
- B. N. Pshenichnyi and Yu. M. Danilin, Numerical Methods in Extremal Problems (Nauka, Moscow, 1975).
- (1975) Numerical Methods in Extremal Problems
- Pshenichnyi, B.N.¹ Danilin Yu., M.²

19
- 0004636939
- P. Pulay, G. Fogarasi, X. Zhou, and P. W. Taylor, Vib. Spectrosc. 1, 159 (1990).
- (1990) Vib. Spectrosc. , vol.1 , pp. 159
- Pulay, P.¹ Fogarasi, G.² Zhou, X.³ Taylor, P.W.⁴

20
- 0346921853
- J. R. Durig and A. Wang, J. Mol. Struct. 293, 13 (1993).
- (1993) J. Mol. Struct. , vol.293 , pp. 13
- Durig, J.R.¹ Wang, A.²

21
- 0003439577
- VCH, Weinheim
- I. Hargittai and M. Hargittai, Symmetry through the Eyes of a Chemist (VCH, Weinheim, 1986).
- (1986) Symmetry Through the Eyes of a Chemist
- Hargittai, I.¹ Hargittai, M.²

22
- 0007144922
- J. E. Boggs, J. Mol. Struct. 130, 31 (1985).
- (1985) J. Mol. Struct. , vol.130 , pp. 31
- Boggs, J.E.¹

23
- 0348251940
- R. S. Wagner and B. P. Dailey, J. Chem. Phys. 26, 1588 (1957).
- (1957) J. Chem. Phys. , vol.26 , pp. 1588
- Wagner, R.S.¹ Dailey, B.P.²

24
- 36849122595
- R. H. Schwendeman and G. D. Jacobs, J. Chem. Phys. 36, 1245 (1962).
- (1962) J. Chem. Phys. , vol.36 , pp. 1245
- Schwendeman, R.H.¹ Jacobs, G.D.²

25
- 21944452123
- W. Brown, Z. Naturfrosch. Teil A 33, 455 (1978).
- (1978) Z. Naturfrosch. Teil A , vol.33 , pp. 455
- Brown, W.¹

26
- 21944432072
- W. Stahl, H. Dreizer, and M. Hayashi, Z. Naturforsch. Teil A 38, 1010 (1983).
- (1983) Z. Naturforsch. Teil A , vol.38 , pp. 1010
- Stahl, W.¹ Dreizer, H.² Hayashi, M.³

27
- 0001082280
- M. Hayashi and T. Inagura, J. Mol. Struct. 220, 103 (1990).
- (1990) J. Mol. Struct. , vol.220 , pp. 103
- Hayashi, M.¹ Inagura, T.²

28
- 36849120083
- L. W. Daasch, C. L. Liang, and J. R. Nielsen, J. Chem. Phys. 22, 1293 (1954).
- (1954) J. Chem. Phys. , vol.22 , pp. 1293
- Daasch, L.W.¹ Liang, C.L.² Nielsen, J.R.³

29
- 0042419749
- G. Allen and H. J. Bernstein, Can. J. Chem. 32, 1124 (1954).
- (1954) Can. J. Chem. , vol.32 , pp. 1124
- Allen, G.¹ Bernstein, H.J.²

30
- 21944438492
- Bulletin NSRDS-NBS6 NBS 6 U.S. GPO, Washington, D.C.
- T. Schimanouchi, Tables of Molecular Vibrational frequencies, Part 1, Bulletin NSRDS-NBS6, p. 40. NBS 6 (U.S. GPO, Washington, D.C., 1967).
- (1967) Tables of Molecular Vibrational Frequencies , Issue.1 PART , pp. 40
- Schimanouchi, T.¹

31
- 21944450747
- I. V. Demidenkova, Trudy. Gos. Inst. Prikl. Khim. 52, 157 (1964).
- (1964) Trudy. Gos. Inst. Prikl. Khim. , vol.52 , pp. 157
- Demidenkova, I.V.¹

32
- 21944446998
- K. D. Möller and L. H. London, J. Chem. Phys. 47, 2505 (1967).
- (1967) J. Chem. Phys. , vol.47 , pp. 2505
- Möller, K.D.¹ London, L.H.²

33
- 0342352284
- F. A. Miller and F. E. Kiviat, Spectrochim. Acta A 25, 1363 (1969).
- (1969) Spectrochim. Acta A , vol.25 , pp. 1363
- Miller, F.A.¹ Kiviat, F.E.²

34
- 0000096444
- F. A. Miller and F. E. Kiviat, Spectrochim. Acta A 26, 315 (1970).
- (1970) Spectrochim. Acta A , vol.26 , pp. 315
- Miller, F.A.¹ Kiviat, F.E.²

35
- 0006877627
- J. R. Durig, W. E. Bucy, L. A. Carreira, and C. J. Wurrey, J. Chem. Phys. 60, 1754 (1974).
- (1974) J. Chem. Phys. , vol.60 , pp. 1754
- Durig, J.R.¹ Bucy, W.E.² Carreira, L.A.³ Wurrey, C.J.⁴

36
- 0039298942
- H. D. Danford and R. L. Livingston, J. Am. Chem. Soc. 81, 4157 (1954).
- (1954) J. Am. Chem. Soc. , vol.81 , pp. 4157
- Danford, H.D.¹ Livingston, R.L.²

37
- 0039891099
- W. H. Flygare, J. Mol. Spectrosc. 14, 145 (1964).
- (1964) J. Mol. Spectrosc. , vol.14 , pp. 145
- Flygare, W.H.¹

38
- 84953651894
- J. Chao, A. S. Rodgers, R. S. Wilhoit, and B. J. Zvolinski, J. Phys. Chem. Ref. Data 3, 141 (1974).
- (1974) J. Phys. Chem. Ref. Data , vol.3 , pp. 141
- Chao, J.¹ Rodgers, A.S.² Wilhoit, R.S.³ Zvolinski, B.J.⁴

39
- 0041078086
- G. Allen, P. N. Brier, and G. Lane, Trans. Faraday Soc. 63, 824 (1967).
- (1967) Trans. Faraday Soc. , vol.63 , pp. 824
- Allen, G.¹ Brier, P.N.² Lane, G.³

40
- 51149211310
- J. R. Durig, S. M. Craven, V. L. Lau, and J. Bragin, J. Chem. Phys. 54, 479 (1971).
- (1971) J. Chem. Phys. , vol.54 , pp. 479
- Durig, J.R.¹ Craven, S.M.² Lau, V.L.³ Bragin, J.⁴

41
- 0011481757
- P. N. Brier, J. Mol. Struct. 6, 23 (1970).
- (1970) J. Mol. Struct. , vol.6 , pp. 23
- Brier, P.N.¹

42
- 8744253105
- P. N. Brier, J. S. Higgins, and R. H. Bradley, Mol. Phys. 21, 721 (1971).
- (1971) Mol. Phys. , vol.21 , pp. 721
- Brier, P.N.¹ Higgins, J.S.² Bradley, R.H.³

43
- 33947088878
- J. R. Durig, A. E. Sloan, and J. D. Witt, J. Chem. Phys. 76, 3591 (1972).
- (1972) J. Chem. Phys. , vol.76 , pp. 3591
- Durig, J.R.¹ Sloan, A.E.² Witt, J.D.³

44
- 0011713802
- J. R. Durig, W. E. Bucy, and C. J. Wurrey, J. Chem. Phys. 60, 3293 (1974).
- (1974) J. Chem. Phys. , vol.60 , pp. 3293
- Durig, J.R.¹ Bucy, W.E.² Wurrey, C.J.³

45
- 21944433307
- R. Hornischer and H. Moser, Spectrochim. Acta A 28, 81 (1972).
- (1972) Spectrochim. Acta A , vol.28 , pp. 81
- Hornischer, R.¹ Moser, H.²

46
- 0000902256
- T. Sakka, Yu. Ogata, and M. Iwasaki, J. Phys. Chem. 96, 10697 (1992).
- (1992) J. Phys. Chem. , vol.96 , pp. 10697
- Sakka, T.¹ Ogata, Yu.² Iwasaki, M.³

47
- 36849098782
- G. Graner and C. Thomas, J. Chem. Phys. 49, 4160 (1968).
- (1968) J. Chem. Phys. , vol.49 , pp. 4160
- Graner, G.¹ Thomas, C.²

48
- 0000302357
- D. C. Smith, G. M. Brown, J. R. Nielsen, R. M. Smith, and C. Y. Liang, J. Chem. Phys. 20, 473 (1952).
- (1952) J. Chem. Phys. , vol.20 , pp. 473
- Smith, D.C.¹ Brown, G.M.² Nielsen, J.R.³ Smith, R.M.⁴ Liang, C.Y.⁵

49
- 0000709157
- F. B. Brown, A. D. H. Claque, N. D. Heitkamp, D. F. Koster, and A. Danti, J. Mol. Spectrosc. 24, 163 (1967).
- (1967) J. Mol. Spectrosc. , vol.24 , pp. 163
- Brown, F.B.¹ Claque, A.D.H.² Heitkamp, N.D.³ Koster, D.F.⁴ Danti, A.⁵

50
- 36849099860
- J. R. Durig, S. M. Craven, C. W. Hawley, and J. Bragin, J. Chem. Phys. 57, 131 (1972).
- (1972) J. Chem. Phys. , vol.57 , pp. 131
- Durig, J.R.¹ Craven, S.M.² Hawley, C.W.³ Bragin, J.⁴

51
- 0001392718
- J. R. Durig, C. J. Wurrey, W. E. Bucy, and A. E. Sloan, Spectrochim. Acta A 32, 175 (1976).
- (1976) Spectrochim. Acta A , vol.32 , pp. 175
- Durig, J.R.¹ Wurrey, C.J.² Bucy, W.E.³ Sloan, A.E.⁴

52
- 37049115222
- R. J. Abraham and K. Parry, J. Chem. Soc. B 3, 539 (1970).
- (1970) J. Chem. Soc. B , vol.3 , pp. 539
- Abraham, R.J.¹ Parry, K.²

53
- 0004133516
- Gaussian, Inc., Pittsburgh PA
- GAUSSIAN 92, M. J. Frisch, G. W. Trucks, M. Head-Gordon, P. M. W. Gill, M. W. Wong, J. B. Foresman, B. J. Johnson, H. B. Schlegel, M. A. Robb, E. S. Replogle, R. Gomperts, J. L. Andres, K. Raghavachari, J. S. Binkley, C. Gonzalez, R. L. Martin, D. J. Fox, D. J. Defrees, J. Baker, J. J. P. Stewart, and J. A. Pople (Gaussian, Inc., Pittsburgh PA, 1992).
- (1992) GAUSSIAN 92
- Frisch, M.J.¹ Trucks, G.W.² Head-Gordon, M.³ Gill, P.M.W.⁴ Wong, M.W.⁵ Foresman, J.B.⁶ Johnson, B.J.⁷ Schlegel, H.B.⁸ Robb, M.A.⁹ Replogle, E.S.¹⁰ Gomperts, R.¹¹ Andres, J.L.¹² Raghavachari, K.¹³ Binkley, J.S.¹⁴ Gonzalez, C.¹⁵ Martin, R.L.¹⁶ Fox, D.J.¹⁷ Defrees, D.J.¹⁸ Baker, J.¹⁹ Stewart, J.J.P.²⁰ Pople, J.A.²¹ more..

54
- 21944449986
- I. V. Kochikov and G. M. Kuramshina, Vestnik Moscov. Univ., Ser. 2, Khimia, 26, 354 (1985).
- (1985) Vestnik Moscov. Univ., Ser. 2, Khimia , vol.26 , pp. 354
- Kochikov, I.V.¹ Kuramshina, G.M.²

55
- 0007851368
- I. V. Kochikov, G. M. Kuramshina, Yu. A. Pentin, V. M. Senyavin, and A. G. Yagola, Russ. J. Phys. Chem. 64, 1830 (1990).
- (1990) Russ. J. Phys. Chem. , vol.64 , pp. 1830
- Kochikov, I.V.¹ Kuramshina, G.M.² Pentin Yu., A.³ Senyavin, V.M.⁴ Yagola, A.G.⁵

56
- 33947479158
- H. A. Bent, Chem. Rev. 61, 275 (1961).
- (1961) Chem. Rev. , vol.61 , pp. 275
- Bent, H.A.¹

57
- 0000520481
- J. M. Martell, R. J. Boyd, and Z. Shi, J. Phys. Chem. 97, 7208 (1993).
- (1993) J. Phys. Chem. , vol.97 , pp. 7208
- Martell, J.M.¹ Boyd, R.J.² Shi, Z.³

58
- 21844500572
- G. M. Kuramshina, F. Weinhold, and Yu. A. Pentin, Russ. J. Phys. Chem. 68, 1828 (1994).
- (1994) Russ. J. Phys. Chem. , vol.68 , pp. 1828
- Kuramshina, G.M.¹ Weinhold, F.² Pentin Yu., A.³

* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.