|
Record
1 of 25 |
|
Author(s): Gonzales, JM; Allen, WD;
Schaefer, HF |
|
Title: Model identity S(N)2 reactions
CH3X+X- (X = F, Cl, CN, OH, SH, NH2, PH2): Marcus theory analyzed |
|
Source: JOURNAL OF PHYSICAL CHEMISTRY A,
109 (46): 10613-10628 NOV 24 2005 |
|
Record
2 of 25 |
|
Author(s): Prakash, MK; Weibel, JD; Marcus,
RA |
|
Title: Isotopomer fractionation in the
UV photolysis of N2O: Comparison of theory and experiment |
|
Source: JOURNAL OF GEOPHYSICAL
RESEARCH-ATMOSPHERES, 110 (D21): Art. No. D21315 NOV 12 2005 |
|
Record
3 of 25 |
|
Author(s): Prakash, MK; Marcus, RA |
|
Title: Three-isotope plot of
fractionation in photolysis: A perturbation theoretical expression |
|
Source: JOURNAL OF CHEMICAL PHYSICS, 123
(17): Art. No. 174308 NOV 1 2005 |
|
Record
4 of 25 |
|
Author(s): Czako, G; Furtenbacher, T;
Csaszar, AG; Szalay, V |
|
Title: Variational vibrational
calculations using high-order anharmonic force fields |
|
Source: MOLECULAR PHYSICS, 102 (23-24):
2411-2423 DEC 10 2004 |
|
Record
5 of 25 |
|
Author(s): Gonzales, JM; Pak, C; Cox, RS;
Allen, WD; Schaefer, HF; Csaszar, AG; Tarczay, G |
|
Title: Definitive ab initio studies of
model S(N)2 reactions CH3X+F- (X = F, Cl, CN, OH, SH, NH2, PH2) |
|
Source: CHEMISTRY-A EUROPEAN JOURNAL, 9
(10): 2173-2192 MAY 23 2003 |
|
Record
6 of 25 |
|
Author(s): Polic, S; Senegacnik, M; Kobal,
I; Zielinski, M |
|
Title: Activated complex in the
decomposition of N2O over Cu |
|
Source: POLISH JOURNAL OF CHEMISTRY, 75
(11): 1729-1738 NOV 2001 |
|
Record
7 of 25 |
|
Author(s): Lapinski, A; Spanget-Larsen, J;
Waluk, J; Radziszewski, JG |
|
Title: Vibrations of nitrous oxide:
Matrix isolation Fourier transform infrared spectroscopy of twelve N2O
isotopomers |
|
Source: JOURNAL OF CHEMICAL PHYSICS, 115
(4): 1757-1764 JUL 22 2001 |
|
Record
8 of 25 |
|
Author(s): Watson, JKG |
|
Title: Mass derivatives of molecular
parameters and distortions in r(m)((2)) structures |
|
Source: JOURNAL OF MOLECULAR
SPECTROSCOPY, 207 (1): 16-24 MAY 2001 |
|
Record
9 of 25 |
|
Author(s): Zemva, P; Lesar, A; Kobal, I;
Senegacnik, M |
|
Title: Interpretation of kinetic
isotope effects in the decomposition of N2O over CoO |
|
Source: CHEMICAL PHYSICS, 264 (3):
413-418 MAR 1 2001 |
|
Record
10 of 25 |
|
Author(s): Zemva, P; Lesar, A; Kobal, I;
Senegacnik, M |
|
Title: Thermal decomposition of N2O
over ZnO: Kinetic isotope effects study |
|
Source: LANGMUIR, 17 (5): 1543-1548 MAR
6 2001 |
|
Record
11 of 25 |
|
Author(s): Gonzalez, M; Valero, R; Sayos, R |
|
Title: Ab initio and quasiclassical
trajectory study of the N(D-2) plus NO(X (2)Pi)-> O(D-1)+N-2(X
(1)Sigma(+)(g)) reaction on the lowest (1)A(') potential energy surface |
|
Source: JOURNAL OF CHEMICAL PHYSICS, 113
(24): 10983-10998 DEC 22 2000 |
|
Record
12 of 25 |
|
Author(s): Aarset, K; Csaszar, AG; Sibert,
EL; Allen, WD; Schaefer, HF; Klopper, W; Noga, J |
|
Title: Anharmonic force field,
vibrational energies, and barrier to inversion of SiH3- |
|
Source: JOURNAL OF CHEMICAL PHYSICS, 112
(9): 4053-4063 MAR 1 2000 |
|
Record
13 of 25 |
|
Author(s): Tarczay, G; Csaszar, AG;
Klopper, W; Szalay, V; Allen, WD; Schaefer, HF |
|
Title: The barrier to linearity of
water |
|
Source: JOURNAL OF CHEMICAL PHYSICS, 110
(24): 11971-11981 JUN 22 1999 |
|
Record
14 of 25 |
|
Author(s): Zuniga, J; Alacid, M; Bastida,
A; Carvajal, FJ; Requena, A |
|
Title: Determination of highly excited
rovibrational states for N2O using generalized internal coordinates |
|
Source: JOURNAL OF CHEMICAL PHYSICS, 110
(13): 6339-6352 APR 1 1999 |
|
Record
15 of 25 |
|
Author(s): Van Huis, TJ; Leininger, ML;
Sherrill, CD; Schaefer, HF |
|
Title: Full configuration interaction
energies, geometries, and quartic force fields of the nitrenium ion |
|
Source: COLLECTION OF CZECHOSLOVAK
CHEMICAL COMMUNICATIONS, 63 (8): 1107-1142 AUG 1998 |
|
Record
16 of 25 |
|
Author(s): Csaszar, AG; Allen, WD;
Schaefer, HF |
|
Title: In pursuit of the ab initio
limit for conformational energy prototypes |
|
Source: JOURNAL OF CHEMICAL PHYSICS, 108
(23): 9751-9764 JUN 15 1998 |
|
Record
17 of 25 |
|
Author(s): Nxumalo, LM; Ford, TA |
|
Title: The Fourier transform infrared
spectrum of the boron trifluoride nitrous oxide complex |
|
Source: SPECTROCHIMICA ACTA PART
A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 53 (14): 2511-2524 DEC 1997 |
|
Record
18 of 25 |
|
Author(s): Bailleux, S; Bogey, M; Demuynck,
C; Destombes, JL; Liu, YY; Csaszar, AG |
|
Title: Ab initio study and
millimeter-wave spectroscopy of P2O |
|
Source: JOURNAL OF CHEMICAL PHYSICS, 107
(20): 8317-8326 NOV 22 1997 |
|
Record
19 of 25 |
|
Author(s): Csaszar, AG; Mills, IM |
|
Title: Vibrational energy levels of
water |
|
Source: SPECTROCHIMICA ACTA PART
A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 53 (8): 1101-1122 JUL 30 1997 |
|
Record
20 of 25 |
|
Author(s): Bahou, M; SchriverMazzuoli, L;
CamyPeyret, C; Schriver, A; Chiavassa, T; Aycard, JP |
|
Title: Infrared matrix spectra of the
N2O center dot center dot center dot O-2 complex in solid nitrogen. The N2O
center dot center dot center dot O-2+O thermal diffusion limited reaction |
|
Source: CHEMICAL PHYSICS LETTERS, 265
(1-2): 145-153 JAN 31 1997 |
|
Record
21 of 25 |
|
Author(s): Zuniga, J; Alacid, M; Bastida,
A; Requena, A |
|
Title: Variational calculations of
vibrational states of N2O using hyperspherical normal coordinates |
|
Source: JOURNAL OF CHEMICAL PHYSICS, 105
(15): 6099-6110 OCT 15 1996 |
|
Record
22 of 25 |
|
Author(s): Csaszar, AG |
|
Title: Conformers of gaseous
alpha-alanine |
|
Source: JOURNAL OF PHYSICAL CHEMISTRY,
100 (9): 3541-3551 FEB 29 1996 |
|
Record
23 of 25 |
|
Author(s): Csaszar, AG; Allen, WD |
|
Title: The effect of 1s correlation on
D-e,r(e), and omega(e) of first-row diatomics |
|
Source: JOURNAL OF CHEMICAL PHYSICS, 104
(7): 2746-2748 FEB 15 1996 |
|
Record
24 of 25 |
|
Author(s): ZUNIGA, J; BASTIDA, A; ALACID,
M; REQUENA, A |
|
Title: HYPERSPHERICAL KINEMATIC
VIBRATIONAL COORDINATES FOR LINEAR TRIATOMIC-MOLECULES |
|
Source: JOURNAL OF PHYSICAL CHEMISTRY,
99 (28): 11051-11060 JUL 13 1995 |
|
Record
25 of 25 |
|
Author(s): BRAS, N; DELARA, EC |
|
Title: ELECTRIC-FIELD EFFECT OBSERVED
ON THE INFRARED-SPECTRA OF THE N2O MOLECULE ADSORBED IN NAA ZEOLITE |
|
Source: JOURNAL OF CHEMICAL PHYSICS, 102
(18): 6990-6999 MAY 8 1995 |