-
1
-
-
33748411633
-
-
0301-7249,. 10.1039/fd9950000039
-
S. B. Barone, A. A. Turnipseed, and A. R. Ravishankara, Faraday Discuss. 0301-7249 100, 39 (1995). 10.1039/fd9950000039
-
(1995)
Faraday Discuss.
, vol.100
, pp. 39
-
-
Barone, S.B.1
Turnipseed, A.A.2
Ravishankara, A.R.3
-
2
-
-
23944465775
-
2CH+CO by the velocity map imaging method
-
DOI 10.1063/1.1995702, 054322
-
K. -C. Lau, Y. Liu, and L. J. Butler, J. Chem. Phys. 0021-9606 123, 054322 (2005). 10.1063/1.1995702 (Pubitemid 41203900)
-
(2005)
Journal of Chemical Physics
, vol.123
, Issue.5
, pp. 1-9
-
-
Lau, K.-C.1
Liu, Y.2
Butler, L.J.3
-
3
-
-
58149216006
-
-
1089-5647.
-
X. N. Tang, B. J. Ratliff, B. L. FitzPatrick, and L. J. Butler, J. Phys. Chem. B 1089-5647 112, 16058 (2008).
-
(2008)
J. Phys. Chem. B
, vol.112
, pp. 16058
-
-
Tang, X.N.1
Ratliff, B.J.2
Fitzpatrick, B.L.3
Butler, L.J.4
-
4
-
-
23944484204
-
2: Thermochemistry and kinetic barriers
-
DOI 10.1016/j.theochem.2005.05.002, PII S016612800500429X
-
L. Zhu and J. W. Bozzelli, J. Mol. Struct.: THEOCHEM 0166-1280 728, 147 (2005). 10.1016/j.theochem.2005.05.002 (Pubitemid 41187779)
-
(2005)
Journal of Molecular Structure: THEOCHEM
, vol.728
, Issue.1-3
, pp. 147-157
-
-
Zhu, L.1
Bozzelli, J.W.2
-
5
-
-
0000885143
-
-
0021-9606,. 10.1063/1.475670
-
J. M. L. Martin, J. Chem. Phys. 0021-9606 108, 2791 (1998). 10.1063/1.475670
-
(1998)
J. Chem. Phys.
, vol.108
, pp. 2791
-
-
Martin, J.M.L.1
-
6
-
-
0001061267
-
-
0009-2614,. 10.1016/S0009-2614(99)00749-6
-
J. M. L. Martin, Chem. Phys. Lett. 0009-2614 310, 271 (1999). 10.1016/S0009-2614(99)00749-6
-
(1999)
Chem. Phys. Lett.
, vol.310
, pp. 271
-
-
Martin, J.M.L.1
-
7
-
-
0035366784
-
Gaussian basis sets for use in correlated molecular calculations. X. The atoms aluminum through argon revisited
-
DOI 10.1063/1.1367373
-
T. H. Dunning, Jr., K. A. Peterson, and A. K. Wilson, J. Chem. Phys. 0021-9606 114, 9244 (2001). 10.1063/1.1367373 (Pubitemid 32535594)
-
(2001)
Journal of Chemical Physics
, vol.114
, Issue.21
, pp. 9244-9253
-
-
Dunning Jr., T.H.1
Peterson, K.A.2
Wilson, A.K.3
-
10
-
-
3843136097
-
-
0009-2614,. 10.1016/j.cplett.2004.06.127
-
R. D. Bell and A. K. Wilson, Chem. Phys. Lett. 0009-2614 394, 105 (2004). 10.1016/j.cplett.2004.06.127
-
(2004)
Chem. Phys. Lett.
, vol.394
, pp. 105
-
-
Bell, R.D.1
Wilson, A.K.2
-
11
-
-
24344477532
-
Density functional theory and the correlation consistent basis sets: The tight d effect on HSO and HOS
-
DOI 10.1021/jp045622b
-
N. X. Wang and A. K. Wilson, J. Phys. Chem. A 1089-5639 109, 7187 (2005). 10.1021/jp045622b (Pubitemid 41260834)
-
(2005)
Journal of Physical Chemistry A
, vol.109
, Issue.32
, pp. 7187-7196
-
-
Wang, N.X.1
Wilson, A.K.2
-
12
-
-
0037468149
-
-
1089-5639,. 10.1021/jp021701g
-
D. Borissenko, A. Kukui, G. Laverdet, and G. Le Bras, J. Phys. Chem. A 1089-5639 107, 1155 (2003). 10.1021/jp021701g
-
(2003)
J. Phys. Chem. A
, vol.107
, pp. 1155
-
-
Borissenko, D.1
Kukui, A.2
Laverdet, G.3
Le Bras, G.4
-
13
-
-
0034628654
-
-
1089-5639,. 10.1021/jp993158i
-
A. Kukui, V. Bossoutrot, G. Laverdet, and G. Le Bras, J. Phys. Chem. A 1089-5639 104, 935 (2000). 10.1021/jp993158i
-
(2000)
J. Phys. Chem. A
, vol.104
, pp. 935
-
-
Kukui, A.1
Bossoutrot, V.2
Laverdet, G.3
Le Bras, G.4
-
14
-
-
33751024934
-
-
0022-3654, () and earlier references within. 10.1021/jp9600120
-
A. Ray, I. Vassalli, G. Laverdet, and G. Le Bras, J. Phys. Chem. 0022-3654 100, 8895 (1996) and earlier references within. 10.1021/jp9600120
-
(1996)
J. Phys. Chem.
, vol.100
, pp. 8895
-
-
Ray, A.1
Vassalli, I.2
Laverdet, G.3
Le Bras, G.4
-
15
-
-
0000010733
-
-
1089-5639,. 10.1021/jp990946z
-
A. J. Frank and F. Turecek, J. Phys. Chem. A 1089-5639 103, 5348 (1999). 10.1021/jp990946z
-
(1999)
J. Phys. Chem. A
, vol.103
, pp. 5348
-
-
Frank, A.J.1
Turecek, F.2
-
16
-
-
0035281407
-
Methylsulfonyl radical unimolecular dissociation studied by deep-UV ultrafast photoionization spectroscopy
-
DOI 10.1021/jp001985+
-
J. C. Owrutsky, H. H. Nelson, and A. P. Baronavski, J. Phys. Chem. A 1089-5639 105, 1440 (2001). 10.1021/jp001985+ (Pubitemid 32255066)
-
(2001)
Journal of Physical Chemistry A
, vol.105
, Issue.9
, pp. 1440-1444
-
-
Owrutsky, J.C.1
Nelson, H.H.2
Baronavski, A.P.3
-
17
-
-
68249129400
-
-
0021-9606.
-
B. W. Alligood, B. L. FitzPatrick, E. J. Glassman, L. J. Butler, and K.-C. Lau, J. Chem. Phys. 0021-9606 131, 044305 (2009).
-
(2009)
J. Chem. Phys.
, vol.131
, pp. 044305
-
-
Alligood, B.W.1
Fitzpatrick, B.L.2
Glassman, E.J.3
Butler, L.J.4
Lau, K.-C.5
-
18
-
-
0001200782
-
-
0066-426X,. 10.1146/annurev.pc.46.100195.002003
-
A. J. R. Heck and D. W. Chandler, Annu. Rev. Phys. Chem. 0066-426X 46, 335 (1995). 10.1146/annurev.pc.46.100195.002003
-
(1995)
Annu. Rev. Phys. Chem.
, vol.46
, pp. 335
-
-
Heck, A.J.R.1
Chandler, D.W.2
-
20
-
-
0001261113
-
-
0022-3654,. 10.1021/j100044a017
-
Y. Sato, Y. Matsumi, M. Kawasaki, K. Tsukiyama, and R. Bersohn, J. Phys. Chem. 0022-3654 99, 16307 (1995). 10.1021/j100044a017
-
(1995)
J. Phys. Chem.
, vol.99
, pp. 16307
-
-
Sato, Y.1
Matsumi, Y.2
Kawasaki, M.3
Tsukiyama, K.4
Bersohn, R.5
-
21
-
-
11144299753
-
C-Cl bond fission dynamics and angular momentum recoupling in the 235 nm photodissociation of allyl chloride
-
DOI 10.1063/1.1812757, 7
-
Y. Liu and L. J. Butler, J. Chem. Phys. 0021-9606 121, 11016 (2004). 10.1063/1.1812757 (Pubitemid 40020637)
-
(2004)
Journal of Chemical Physics
, vol.121
, Issue.22
, pp. 11016-11022
-
-
Liu, Y.1
Butler, L.J.2
-
22
-
-
68249084659
-
-
Note that most authors label the upper state for detection of Cl (P2 1/2) as the 4P2 1/2 state from, NSRDS-NBS, (); however, the NIST Atomic Spectra Database has adopted the reassignment of this upper state at 85 917.937 cm-1 to a S2 state, as recommended in the comprehensive reanalysis of the chlorine spectrum by, 0030-3941 59, 424 (1969). (To avoid confusion, we give the original C. E. Moore assignment here. For the energy of the transition, we use the NIST value of 85 917.937-882.3515 cm-1.) 10.1364/JOSA.59.000424
-
Note that most authors label the upper state for detection of Cl (P2 1/2) as the 4p P2 1/2 state from C. E. Moore, NSRDS-NBS 35, 1 (1971); however, the NIST Atomic Spectra Database has adopted the reassignment of this upper state at 85 917.937 cm-1 to a S2 state, as recommended in the comprehensive reanalysis of the chlorine spectrum by L. J. Radziemski, Jr. and V. Kaufman, J. Opt. Soc. Am. 0030-3941 59, 424 (1969). (To avoid confusion, we give the original C. E. Moore assignment here. For the energy of the transition, we use the NIST value of 85 917.937-882.3515 cm-1.) 10.1364/JOSA.59.000424
-
(1971)
J. Opt. Soc. Am.
, vol.35
, pp. 1
-
-
Moore, C.E.1
Radziemski Jr., L.J.2
Kaufman, V.3
-
23
-
-
0001731175
-
-
0034-6748,. 10.1063/1.1148824
-
B. Chang, R. C. Hoetzlein, J. A. Mueller, J. D. Geiser, and P. L. Houston, Rev. Sci. Instrum. 0034-6748 69, 1665 (1998). 10.1063/1.1148824
-
(1998)
Rev. Sci. Instrum.
, vol.69
, pp. 1665
-
-
Chang, B.1
Hoetzlein, R.C.2
Mueller, J.A.3
Geiser, J.D.4
Houston, P.L.5
-
24
-
-
0002745201
-
-
0009-2614, () 10.1016/0009-2614(92)86093-W;, Chem. Phys. Lett. 0009-2614 227, 321 (1994) 10.1016/0009-2614(94)00815-9;, J. Chem. Phys. 0021-9606 99, 5219 (1993). 10.1063/1.465990
-
C. Hampel, K. A. Peterson, and H. Werner, Chem. Phys. Lett. 0009-2614 190, 1 (1992) 10.1016/0009-2614(92)86093-W; M. J. O. Deegan and P. J. Knowles, Chem. Phys. Lett. 0009-2614 227, 321 (1994) 10.1016/0009-2614(94)00815-9; P. J. Knowles, C. Hampel, and H. J. Werner, J. Chem. Phys. 0021-9606 99, 5219 (1993). 10.1063/1.465990
-
(1992)
Chem. Phys. Lett.
, vol.190
, pp. 1
-
-
Hampel, C.1
Peterson, K.A.2
Werner, H.3
Deegan, M.J.O.4
Knowles, P.J.5
Knowles, P.J.6
Hampel, C.7
Werner, H.J.8
-
25
-
-
33746614482
-
-
0021-9606,. 10.1063/1.456153
-
T. H. Dunning, Jr., J. Chem. Phys. 0021-9606 90, 1007 (1989). 10.1063/1.456153
-
(1989)
J. Chem. Phys.
, vol.90
, pp. 1007
-
-
Dunning Jr., T.H.1
-
27
-
-
0035147918
-
-
0021-9606, () 10.1063/1.1329891;, Ann. Phys. 0003-3804 82, 89 (1974). 10.1016/0003-4916(74)90333-9
-
W. A. de Jong, R. J. Harrison, and D. A. Dixon, J. Chem. Phys. 0021-9606 114, 48 (2001) 10.1063/1.1329891; M. Douglas and N. M. Kroll, Ann. Phys. 0003-3804 82, 89 (1974). 10.1016/0003-4916(74)90333-9
-
(2001)
J. Chem. Phys.
, vol.114
, pp. 48
-
-
De Jong, W.A.1
Harrison, R.J.2
Dixon, D.A.3
Douglas, M.4
Kroll, N.M.5
-
28
-
-
68249089854
-
-
MOLPRO is a package of ab initio programs.
-
H. -J. Werner, P. J. Knowles, R. Lindh, F. R. Manby, M. Schütz, P. Celani, T. Korona, G. Rauhut, R. D. Amos, A. Bernhardsson, A. Berning, D. L. Cooper, M. J. O. Deegan, A. J. Dobbyn, F. Eckert, C. Hampel, G. Hetzer, A. W. Lloyd, S. J. McNicholas, W. Meyer, M. E. Mura, A. Nicklaß, P. Palmieri, R. Pitzer, U. Schumann, H. Stoll, A. J. Stone, R. Tarroni, and T. Thorsteinsson, MOLPRO is a package of ab initio programs.
-
-
-
Werner, H.-J.1
Knowles, P.J.2
Lindh, R.3
Manby, F.R.4
Schütz, M.5
Celani, P.6
Korona, T.7
Rauhut, G.8
Amos, R.D.9
Bernhardsson, A.10
Berning, A.11
Cooper, D.L.12
Deegan, M.J.O.13
Dobbyn, A.J.14
Eckert, F.15
Hampel, C.16
Hetzer, G.17
Lloyd, A.W.18
McNicholas, S.J.19
Meyer, W.20
Mura, M.E.21
Nicklaß, A.22
Palmieri, P.23
Pitzer, R.24
Schumann, U.25
Stoll, H.26
Stone, A.J.27
Tarroni, R.28
Thorsteinsson, T.29
more..
-
29
-
-
68249106660
-
-
Atomic Energy Levels, Natl. Bur. Stand. (U.S.) Circ. No. 467 (U.S. GPO, Washingtons, D.C.).
-
C. E. Moore, Atomic Energy Levels, Natl. Bur. Stand. (U.S.) Circ. No. 467 (U.S. GPO, Washingtons, D.C., 1949).
-
(1949)
-
-
Moore, C.E.1
-
30
-
-
68249114597
-
-
2 potential energy surface calculated at the CCSD(T) level of theory. Also found in the supplementary material are some experimental data and rate constant calculations not included in the manuscript.
-
2 potential energy surface calculated at the CCSD(T) level of theory. Also found in the supplementary material are some experimental data and rate constant calculations not included in the manuscript.
-
-
-
-
31
-
-
68249120900
-
-
GAUSSIAN 03, Revision E.01, Gaussian, Inc., Wallingford CT.
-
M. J. Frisch, G. W. Trucks, H. B. Schlegel, GAUSSIAN 03, Revision E.01, Gaussian, Inc., Wallingford CT, 2004.
-
(2004)
-
-
Frisch, M.J.1
Trucks, G.W.2
Schlegel, H.B.3
-
32
-
-
0036639401
-
Reconstruction of Abel-transformable images: The Gaussian basis-set expansion Abel transform method
-
DOI 10.1063/1.1482156
-
V. Dribinski, A. Ossadtchi, V. A. Mandelshtam, and H. Reisler, Rev. Sci. Instrum. 0034-6748 73, 2634 (2002). 10.1063/1.1482156 (Pubitemid 34802931)
-
(2002)
Review of Scientific Instruments
, vol.73
, Issue.7
, pp. 2634
-
-
Dribinski, V.1
Ossadtchi, A.2
Mandelshtam, V.A.3
Reisler, H.4
-
33
-
-
36449000783
-
-
0021-9606,. 10.1063/1.470360
-
R. Liyanage, Y. A. Yang, S. Hashimoto, R. J. Gordon, and R. W. Field, J. Chem. Phys. 0021-9606 103, 6811 (1995). 10.1063/1.470360
-
(1995)
J. Chem. Phys.
, vol.103
, pp. 6811
-
-
Liyanage, R.1
Yang, Y.A.2
Hashimoto, S.3
Gordon, R.J.4
Field, R.W.5
-
34
-
-
0041689437
-
-
0022-3654,. 10.1021/j100062a009
-
J. Berkowitz, G. B. Ellison, and D. Gutman, J. Phys. Chem. 0022-3654 98, 2744 (1994). 10.1021/j100062a009
-
(1994)
J. Phys. Chem.
, vol.98
, pp. 2744
-
-
Berkowitz, J.1
Ellison, G.B.2
Gutman, D.3
-
35
-
-
0001640874
-
-
1089-5639,. 10.1021/jp972627i
-
T. Shibata, H. Li, H. Katayanagi, and T. Suzuki, J. Phys. Chem. A 1089-5639 102, 3643 (1998). 10.1021/jp972627i
-
(1998)
J. Phys. Chem. A
, vol.102
, pp. 3643
-
-
Shibata, T.1
Li, H.2
Katayanagi, H.3
Suzuki, T.4
-
36
-
-
0035311610
-
-
MULTIWELL-2009.2 software, May, designed and maintained by with contributors, University of Michigan, Ann Arbor, MI,;, 0538-8066, (2001). 10.1002/kin.1017
-
MULTIWELL-2009.2 software, May 2009, designed and maintained by J. R. Barker with contributors N. F. Ortiz, J. M. Preses, L. L. Lohr, A. Maranzana, P. J. Stimac, and L. T. Nguyen, University of Michigan, Ann Arbor, MI, http://aoss.engin.umich.edu/multiwell/; J. R. Barker, Int. J. Chem. Kinet. 0538-8066 33, 232 (2001). 10.1002/kin.1017
-
(2009)
Int. J. Chem. Kinet.
, vol.33
, pp. 232
-
-
Barker, J.R.1
Ortiz, N.F.2
Preses, J.M.3
Lohr, L.L.4
Maranzana, A.5
Stimac, P.J.6
Nguyen, L.T.7
Barker, J.R.8
-
37
-
-
0004255534
-
-
See Eq. 3.21 in, 2nd ed. (Wiley, Chichester).
-
See Eq. 3.21 in K. A. Holbrook, M. J. Pilling, and S. H. Robertson, Unimolecular Reactions, 2nd ed. (Wiley, Chichester, 1996).
-
(1996)
Unimolecular Reactions
-
-
Holbrook, K.A.1
Pilling, M.J.2
Robertson, S.H.3
|