-
1
-
-
0001676630
-
-
0021-9606 10.1063/1.459927.
-
K. S. Kim, H. S. Kim, J. H. Jang, H. S. Kim, B. -J. Mhin, Y. Xie, and H. F. Schaefer III, J. Chem. Phys. 0021-9606 10.1063/1.459927 94, 2057 (1991).
-
(1991)
J. Chem. Phys.
, vol.94
, pp. 2057
-
-
Kim, K.S.1
Kim, H.S.2
Jang, J.H.3
Kim, H.S.4
Mhin, B.-J.5
Xie, Y.6
Iii, F.S.H.7
-
2
-
-
36449002250
-
-
0021-9606 10.1063/1.464492.
-
Y. Xie and H. F. Schaefer III, J. Chem. Phys. 0021-9606 10.1063/1.464492 98, 8829 (1993).
-
(1993)
J. Chem. Phys.
, vol.98
, pp. 8829
-
-
Xie, Y.1
Iii, F.S.H.2
-
3
-
-
0003030547
-
-
0009-2614 10.1016/S0009-2614(99)00190-6.
-
B. Wang, H. Hou, and Y. Gu, Chem. Phys. Lett. 0009-2614 10.1016/S0009-2614(99)00190-6 303, 96 (1999).
-
(1999)
Chem. Phys. Lett.
, vol.303
, pp. 96
-
-
Wang, B.1
Hou, H.2
Gu, Y.3
-
5
-
-
0037144619
-
-
0020-7608 10.1002/qua.10315.
-
Z. Zhou, Y. Qu, A. Fu, B. Du, F. He, and H. Gao, Int. J. Quantum Chem. 0020-7608 10.1002/qua.10315 89, 550 (2002).
-
(2002)
Int. J. Quantum Chem.
, vol.89
, pp. 550
-
-
Zhou, Z.1
Qu, Y.2
Fu, A.3
Du, B.4
He, F.5
Gao, H.6
-
6
-
-
0038627686
-
-
0002-7863 10.1021/ja034388k.
-
P. D. Cooper, H. G. Kjaergaard, V. S. Langford, A. J. McKinley, T. I. Quickenden, and D. P. Schofield, J. Am. Chem. Soc. 0002-7863 10.1021/ja034388k 125, 6048 (2003).
-
(2003)
J. Am. Chem. Soc.
, vol.125
, pp. 6048
-
-
Cooper, P.D.1
Kjaergaard, H.G.2
Langford, V.S.3
McKinley, A.J.4
Quickenden, T.I.5
Schofield, D.P.6
-
10
-
-
11144351922
-
-
0009-2614 10.1016/j.cplett.2004.11.090.
-
C. S. Brauer, G. Sedo, E. M. Grumstrup, K. R. Leopold, M. D. Marshall, and H. O. Leung, Chem. Phys. Lett. 0009-2614 10.1016/j.cplett.2004.11.090 401, 420 (2005).
-
(2005)
Chem. Phys. Lett.
, vol.401
, pp. 420
-
-
Brauer, C.S.1
Sedo, G.2
Grumstrup, E.M.3
Leopold, K.R.4
Marshall, M.D.5
Leung, H.O.6
-
11
-
-
13644268566
-
-
0002-7863 10.1021/ja0442973.
-
Y. Ohshima, K. Sato, Y. Sumiyoshi, and Y. Endo, J. Am. Chem. Soc. 0002-7863 10.1021/ja0442973 127, 1108 (2005).
-
(2005)
J. Am. Chem. Soc.
, vol.127
, pp. 1108
-
-
Ohshima, Y.1
Sato, K.2
Sumiyoshi, Y.3
Endo, Y.4
-
12
-
-
17644363373
-
-
0020-7608 10.1002/qua.20415.
-
X. -L. Dong, Z. -Y. Zhou, L. -J. Tian, and G. Zhao, Int. J. Quantum Chem. 0020-7608 10.1002/qua.20415 102, 461 (2005).
-
(2005)
Int. J. Quantum Chem.
, vol.102
, pp. 461
-
-
Dong, X.-L.1
Zhou, Z.-Y.2
Tian, L.-J.3
Zhao, G.4
-
13
-
-
33845197793
-
-
0021-9606 10.1063/1.2388260.
-
T. D. Crawford, M. L. Abrams, R. A. King, J. R. Lane, D. P. Schofield, and H. G. Kjaergaard, J. Chem. Phys. 0021-9606 10.1063/1.2388260 125, 204302 (2006).
-
(2006)
J. Chem. Phys.
, vol.125
, pp. 204302
-
-
Crawford, T.D.1
Abrams, M.L.2
King, R.A.3
Lane, J.R.4
Schofield, D.P.5
Kjaergaard, H.G.6
-
14
-
-
33846117091
-
-
1089-5639 10.1021/jp064468l.
-
M. A. Allodi, M. E. Dunn, J. Livada, K. N. Kirschner, and G. C. Shields, J. Phys. Chem. A 1089-5639 10.1021/jp064468l 110, 13283 (2006).
-
(2006)
J. Phys. Chem. A
, vol.110
, pp. 13283
-
-
Allodi, M.A.1
Dunn, M.E.2
Livada, J.3
Kirschner, K.N.4
Shields, G.C.5
-
15
-
-
33745145460
-
-
0021-9606 10.1063/1.2200701.
-
S. Du, J. S. Francisco, G. K. Schenter, T. D. Iordanov, B. C. Garrett, M. Dupuis, and J. Li, J. Chem. Phys. 0021-9606 10.1063/1.2200701 124, 224318 (2006).
-
(2006)
J. Chem. Phys.
, vol.124
, pp. 224318
-
-
Du, S.1
Francisco, J.S.2
Schenter, G.K.3
Iordanov, T.D.4
Garrett, B.C.5
Dupuis, M.6
Li, J.7
-
16
-
-
33749659533
-
-
1463-9076 10.1039/b609330b.
-
D. C. McCabe, B. Rajakumar, P. Marshall, I. W. M. Smith, and A. R. Ravishankara, Phys. Chem. Chem. Phys. 1463-9076 10.1039/b609330b 8, 4563 (2006).
-
(2006)
Phys. Chem. Chem. Phys.
, vol.8
, pp. 4563
-
-
McCabe, D.C.1
Rajakumar, B.2
Marshall, P.3
Smith, I.W.M.4
Ravishankara, A.R.5
-
17
-
-
34248389245
-
-
0192-8651 10.1002/jcc.20638.
-
C. -H. Lai and P. -T. Chou, J. Comput. Chem. 0192-8651 10.1002/jcc.20638 28, 1357 (2007).
-
(2007)
J. Comput. Chem.
, vol.28
, pp. 1357
-
-
Lai, C.-H.1
Chou, P.-T.2
-
20
-
-
0043285115
-
-
0192-8651 10.1002/jcc.10327.
-
T. Uchimaru, A. K. Chandra, S. Tsuzuki, M. Sugie, and A. Sekiya, J. Comput. Chem. 0192-8651 10.1002/jcc.10327 24, 1538 (2003).
-
(2003)
J. Comput. Chem.
, vol.24
, pp. 1538
-
-
Uchimaru, T.1
Chandra, A.K.2
Tsuzuki, S.3
Sugie, M.4
Sekiya, A.5
-
21
-
-
20344374994
-
-
0166-1280 10.1016/j.theochem.2004.10.075.
-
N. Karakus and R. Ozkan, J. Mol. Struct.: THEOCHEM 0166-1280 10.1016/j.theochem.2004.10.075 724, 39 (2005).
-
(2005)
J. Mol. Struct.: THEOCHEM
, vol.724
, pp. 39
-
-
Karakus, N.1
Ozkan, R.2
-
23
-
-
0142180088
-
-
0021-9606 10.1063/1.1605939.
-
P. Cabral do Couto, R. C. Guedes, B. J. Costa Cabral, and J. A. Martinho Simes, J. Chem. Phys. 0021-9606 10.1063/1.1605939 119, 7344 (2003).
-
(2003)
J. Chem. Phys.
, vol.119
, pp. 7344
-
-
Cabral Do Couto, P.1
Guedes, R.C.2
Costa Cabral, B.J.3
Martinho Simes, J.A.4
-
26
-
-
0000731948
-
-
(a), () 0080-4630; (b), Proc. R. Soc. London 381, 419 (1982). 0080-4630
-
(a) J. W. Bevan, Z. Kisiel, A. C. Legon, D. J. Millen, and S. C. Rogers, Proc. R. Soc. London 372, 441 (1980) 0080-4630; (b) Z. Kisiel, A. C. Legon, and D. J. Millen, Proc. R. Soc. London 381, 419 (1982). 0080-4630
-
(1980)
Proc. R. Soc. London
, vol.372
, pp. 441
-
-
Bevan, J.W.1
Kisiel, Z.2
Legon, A.C.3
Millen, D.J.4
Rogers, S.C.5
Kisiel, Z.6
Legon, A.C.7
Millen, D.J.8
-
28
-
-
4344620108
-
-
0021-9606 10.1063/1.1768933.
-
J. B. Davey, M. E. Greenslade, M. D. Marshall, M. I. Lester, and M. D. Wheeler, J. Chem. Phys. 0021-9606 10.1063/1.1768933 121, 3009 (2004).
-
(2004)
J. Chem. Phys.
, vol.121
, pp. 3009
-
-
Davey, J.B.1
Greenslade, M.E.2
Marshall, M.D.3
Lester, M.I.4
Wheeler, M.D.5
-
29
-
-
0000788492
-
-
0022-2852 10.1016/0022-2852(89)90137-9.
-
W. M. Fawzy and J. T. Hougen, J. Mol. Spectrosc. 0022-2852 10.1016/0022-2852(89)90137-9 137, 154 (1989).
-
(1989)
J. Mol. Spectrosc.
, vol.137
, pp. 154
-
-
Fawzy, W.M.1
Hougen, J.T.2
-
30
-
-
0029550904
-
-
0002-7863 10.1021/ja00155a018.
-
J. A. Phillips, M. Canagaratna, H. Goodfriend, A. Grushow, J. Almlöf, and K. R. Leopold, J. Am. Chem. Soc. 0002-7863 10.1021/ja00155a018 117, 12549 (1995).
-
(1995)
J. Am. Chem. Soc.
, vol.117
, pp. 12549
-
-
Phillips, J.A.1
Canagaratna, M.2
Goodfriend, H.3
Grushow, A.4
Almlöf, J.5
Leopold, K.R.6
-
31
-
-
51749109528
-
-
We are grateful to Dr. Y. Sumiyoshi and Professor Y. Endo for bringing to our attention discrepancies between their observed frequencies and those of our previous work.
-
We are grateful to Dr. Y. Sumiyoshi and Professor Y. Endo for bringing to our attention discrepancies between their observed frequencies and those of our previous work.
-
-
-
-
32
-
-
51749098397
-
-
Subsequent to the replacement of our support rods, all of our newly measured frequencies for the parent species agreed with those of Ohshima (Ref.) to within 22 kHz, with most agreeing to better than 10 kHz.
-
Subsequent to the replacement of our support rods, all of our newly measured frequencies for the parent species agreed with those of Ohshima (Ref.) to within 22 kHz, with most agreeing to better than 10 kHz.
-
-
-
-
35
-
-
0003003972
-
-
0021-9606 10.1063/1.469626.
-
Y. Kasai, K. Obi, Y. Ohshima, Y. Endo, and K. Kawaguchi, J. Chem. Phys. 0021-9606 10.1063/1.469626 103, 90 (1995).
-
(1995)
J. Chem. Phys.
, vol.103
, pp. 90
-
-
Kasai, Y.1
Obi, K.2
Ohshima, Y.3
Endo, Y.4
Kawaguchi, K.5
-
40
-
-
0347601097
-
-
0022-2852 10.1016/0022-2852(81)90300-3.
-
J. M. Brown, C. M. L. Kerr, F. D. Wayne, K. M. Evenson, and H. E. Radford, J. Mol. Spectrosc. 0022-2852 10.1016/0022-2852(81)90300-3 86, 544 (1981).
-
(1981)
J. Mol. Spectrosc.
, vol.86
, pp. 544
-
-
Brown, J.M.1
Kerr, C.M.L.2
Wayne, F.D.3
Evenson, K.M.4
Radford, H.E.5
-
41
-
-
21844458525
-
-
E. R. Comben, J. M. Brown, T. C. Steimle, K. R. Leopold, and K. M. Evenson, Astrophys. J. 305, 513 (1986).
-
(1986)
Astrophys. J.
, vol.305
, pp. 513
-
-
Comben, E.R.1
Brown, J.M.2
Steimle, T.C.3
Leopold, K.R.4
Evenson, K.M.5
-
42
-
-
51749083675
-
-
NIST Physical Reference Data.
-
NIST Physical Reference Data: http://physics.nist.gov/PhysRefData/ MolSpec/Diatomic/Html/Tables/OH.html.
-
-
-
-
43
-
-
51749099535
-
-
Our previous work employed the values ASO (O 16 H) =-4 157 663 MHz and ASO (O 18 H) =-4 157 071 MHz. The current fits employ better values, ASO (O 16 H) =-4 168 639.13 MHz and ASO (O 18 H) =-4 168 644.9 MHz taken from Refs..
-
Our previous work employed the values ASO (O 16 H) =-4 157 663 MHz and ASO (O 18 H) =-4 157 071 MHz. The current fits employ better values, ASO (O 16 H) =-4 168 639.13 MHz and ASO (O 18 H) =-4 168 644.9 MHz taken from Refs..
-
-
-
-
44
-
-
36549013087
-
-
0021-9606 10.1063/1.2804770.
-
S. Wu, G. Sedo, E. M. Grumstrup, and K. R. Leopold, J. Chem. Phys. 0021-9606 10.1063/1.2804770 127, 204315 (2007).
-
(2007)
J. Chem. Phys.
, vol.127
, pp. 204315
-
-
Wu, S.1
Sedo, G.2
Grumstrup, E.M.3
Leopold, K.R.4
-
45
-
-
0000711186
-
-
0022-2852 10.1016/0022-2852(91)90124-S.
-
H. M. Pickett, J. Mol. Spectrosc. 0022-2852 10.1016/0022-2852(91)90124-S 148, 371 (1991).
-
(1991)
J. Mol. Spectrosc.
, vol.148
, pp. 371
-
-
Pickett, H.M.1
-
46
-
-
51749113967
-
-
The energy interval referred to in Ref. is the off-diagonal element of the 2×2 matrix described in that paper and thus corresponds exactly to our parameter, ρ., private communication (July 3, 2008).
-
The energy interval referred to in Ref. is the off-diagonal element of the 2×2 matrix described in that paper and thus corresponds exactly to our parameter, ρ. Y. Sumiyoshi, private communication (July 3, 2008).
-
-
-
Sumiyoshi, Y.1
-
48
-
-
26844534384
-
-
0021-9606 10.1063/1.438955.
-
R. Krishnan, J. S. Binkley, R. Seeger, and J. A. Pople, J. Chem. Phys. 0021-9606 10.1063/1.438955 72, 650 (1980).
-
(1980)
J. Chem. Phys.
, vol.72
, pp. 650
-
-
Krishnan, R.1
Binkley, J.S.2
Seeger, R.3
Pople, J.A.4
-
49
-
-
84986468715
-
-
0192-8651 10.1002/jcc.540040303.
-
T. Clark, J. Chandrasekhar, G. W. Spitznagel, and P. v. R. Schleyer, J. Comput. Chem. 0192-8651 10.1002/jcc.540040303 4, 294 (1983).
-
(1983)
J. Comput. Chem.
, vol.4
, pp. 294
-
-
Clark, T.1
Chandrasekhar, J.2
Spitznagel, G.W.3
Schleyer, V.P.R.4
-
51
-
-
51749102609
-
-
GAUSSIAN 03, Revision C.02, Gaussian, Inc., Wallingford, CT.
-
M. J. Frisch, G. W. Trucks, H. B. Schlegel, GAUSSIAN 03, Revision C.02, Gaussian, Inc., Wallingford, CT, 2004.
-
(2004)
-
-
Frisch, M.J.1
Trucks, G.W.2
Schlegel, H.B.3
-
52
-
-
11744301188
-
-
0009-2614 10.1016/0009-2614(88)87412-8.
-
P. J. Knowles and H. -J. Werner, Chem. Phys. Lett. 0009-2614 10.1016/0009-2614(88)87412-8 145, 514 (1988).
-
(1988)
Chem. Phys. Lett.
, vol.145
, pp. 514
-
-
Knowles, P.J.1
Werner, H.-J.2
-
55
-
-
0034634787
-
-
0026-8976 10.1080/00268970050177710.
-
A. Berning, M. Schweizer, H. -J. Werner, P. J. Knowles, and P. Palmieri, Mol. Phys. 0026-8976 10.1080/00268970050177710 98, 1823 (2000).
-
(2000)
Mol. Phys.
, vol.98
, pp. 1823
-
-
Berning, A.1
Schweizer, M.2
Werner, H.-J.3
Knowles, P.J.4
Palmieri, P.5
-
56
-
-
51749089950
-
-
MOLPRO-version 2002.6, University of Birmingham, Birmingham, see.
-
H. -J. Werner, P. J. Knowles, R. Lindh, M. Schuetz, MOLPRO-version 2002.6, University of Birmingham, Birmingham, 2002, see http://www.molpro.net.
-
(2002)
-
-
Werner, H.-J.1
Knowles, P.J.2
Lindh, R.3
Schuetz, M.4
-
57
-
-
0042977504
-
-
0034-6861 10.1103/RevModPhys.32.179.
-
C. C. J. Roothaan, Rev. Mod. Phys. 0034-6861 10.1103/RevModPhys.32.179 32, 179 (1960).
-
(1960)
Rev. Mod. Phys.
, vol.32
, pp. 179
-
-
Roothaan, C.C.J.1
-
60
-
-
36749110793
-
-
0021-9606 10.1063/1.437733.
-
C. A. Mead, J. Chem. Phys. 0021-9606 10.1063/1.437733 70, 2276 (1979).
-
(1979)
J. Chem. Phys.
, vol.70
, pp. 2276
-
-
Mead, C.A.1
-
61
-
-
0011934857
-
-
1050-2947 10.1103/PhysRevA.5.487.
-
F. C. De Lucia, P. Helminger, R. L. Cook, and W. Gordy, Phys. Rev. A 1050-2947 10.1103/PhysRevA.5.487 5, 487 (1972).
-
(1972)
Phys. Rev. A
, vol.5
, pp. 487
-
-
De Lucia, F.C.1
Helminger, P.2
Cook, R.L.3
Gordy, W.4
-
62
-
-
0012841807
-
-
1050-2947 10.1103/PhysRevA.6.1324.
-
F. C. De Lucia, P. Helminger, R. L. Cook, and W. Gordy, Phys. Rev. A 1050-2947 10.1103/PhysRevA.6.1324 6, 1324 (1972).
-
(1972)
Phys. Rev. A
, vol.6
, pp. 1324
-
-
De Lucia, F.C.1
Helminger, P.2
Cook, R.L.3
Gordy, W.4
-
63
-
-
0011713789
-
-
0009-2614 10.1016/0009-2614(82)83423-4.
-
A. C. Legon and L. C. Willoughby, Chem. Phys. Lett. 0009-2614 10.1016/0009-2614(82)83423-4 92, 333 (1982).
-
(1982)
Chem. Phys. Lett.
, vol.92
, pp. 333
-
-
Legon, A.C.1
Willoughby, L.C.2
|