Volume 9; Issue 31

Physical Chemistry Chemical Physics

Volume 9; Issue 31

1

Kinetic modelling of the oxidation of large aliphatic hydrocarbons using an automatic mechanism generation

Muharam, Yuswan, Warnatz, Jürgen

Journal:

Physical Chemistry Chemical Physics

Year:

2007

Language:

english

File:

PDF, 2.19 MB

english, 2007

2

Synergies between experimental and theoretical studies of gas phase reactions

Journal:

Physical Chemistry Chemical Physics

Year:

2007

Language:

english

File:

PDF, 613 KB

english, 2007

3

Ab initio methods for reactive potential surfaces

Harding, Lawrence B., Klippenstein, Stephen J., Jasper, Ahren W.

Journal:

Physical Chemistry Chemical Physics

Year:

2007

Language:

english

File:

PDF, 2.44 MB

english, 2007

4

Kinetic parameters for gas-phase reactions: Experimental and theoretical challenges

Carl, S. A., Vereecken, L., Peeters, J.

Journal:

Physical Chemistry Chemical Physics

Year:

2007

Language:

english

File:

PDF, 1.27 MB

english, 2007

5

Steady-state master equation methods

Green, Nicholas J. B., Bhatti, Zaheer A.

Journal:

Physical Chemistry Chemical Physics

Year:

2007

Language:

english

File:

PDF, 1.33 MB

english, 2007

6

10.1039/b614502g

Journal:

Physical Chemistry Chemical Physics

Language:

english

File:

PDF, 2.44 MB

english

7

Kinetics, mechanism, and thermochemistry of the gas-phase reaction of atomic chlorine with pyridine

Zhao, Z., Huskey, D. T., Olsen, K. J., Nicovich, J. M., McKee, M. L., Wine, P. H.

Journal:

Physical Chemistry Chemical Physics

Year:

2007

Language:

english

File:

PDF, 1.29 MB

english, 2007

8

Master equation simulations of competing unimolecular and bimolecular reactions: application to OH production in the reaction of acetyl radical with O2

Maranzana, Andrea, Barker, John R., Tonachini, Glauco

Journal:

Physical Chemistry Chemical Physics

Year:

2007

Language:

english

File:

PDF, 1.67 MB

english, 2007

9

Hydrocarbon fuel effects in solid-oxide fuel cell operation: an experimental and modeling study of n-hexane pyrolysis

Randolph, Katie L., Dean, Anthony M.

Journal:

Physical Chemistry Chemical Physics

Year:

2007

Language:

english

File:

PDF, 1.59 MB

english, 2007

10

Master equation methods for multiple well systems: application to the 1-,2-pentyl system

Robertson, Struan H., Pilling, Michael J., Jitariu, Luminita C., Hillier, Ian H.

Journal:

Physical Chemistry Chemical Physics

Year:

2007

Language:

english

File:

PDF, 1.21 MB

english, 2007

11

Contents and Chemical Science

Journal:

Physical Chemistry Chemical Physics

Year:

2007

Language:

english

File:

PDF, 8.18 MB

english, 2007

12

The atmospheric oxidation of diethyl ether: chemistry of the C2H5–O–CH(O˙)CH3 radical between 218 and 335 K

Orlando, John J.

Journal:

Physical Chemistry Chemical Physics

Year:

2007

Language:

english

File:

PDF, 1.14 MB

english, 2007

13

Association rate constants for reactions between resonance-stabilized radicals: C3H3 + C3H3, C3H3 + C3H5, and C3H5 + C3H5

Georgievskii, Yuri, Miller, James A., Klippenstein, Stephen J.

Journal:

Physical Chemistry Chemical Physics

Year:

2007

Language:

english

File:

PDF, 2.00 MB

english, 2007

14

High pressure effects on the mutual sensitization of the oxidation of NO and CH4–C2H6 blends

Sivaramakrishnan, Raghu, Brezinsky, Kenneth, Dayma, Guillaume, Dagaut, Philippe

Journal:

Physical Chemistry Chemical Physics

Year:

2007

Language:

english

File:

PDF, 1.33 MB

english, 2007

15

Kinetics and branching ratio studies of the reaction of C2H5O2 + HO2 using chemical ionisation mass spectrometry

Teresa Raventós-Duran, M., Percival, Carl J., McGillen, Max R., Hamer, Paul D., Shallcross, Dudley E.

Journal:

Physical Chemistry Chemical Physics

Year:

2007

Language:

english

File:

PDF, 1.33 MB

english, 2007

16

Diazo chemistry controlling the selectivity of olefin ketonisation by nitrous oxide

Hermans, Ive, Moens, Bart, Peeters, Jozef, Jacobs, Pierre, Sels, Bert

Journal:

Physical Chemistry Chemical Physics

Year:

2007

Language:

english

File:

PDF, 1.10 MB

english, 2007

17

Determination of the rate constant and product channels for the radical–radical reaction NCO(X 2Π) + C2H5(X 2A″) at 293 K

Glen Macdonald, R.

Journal:

Physical Chemistry Chemical Physics

Year:

2007

Language:

english

File:

PDF, 1.28 MB

english, 2007

18

Front cover

Journal:

Physical Chemistry Chemical Physics

Year:

2007

Language:

english

File:

PDF, 1.23 MB

english, 2007

19

A combined experimental and theoretical study of the reaction between methylglyoxal and OH/OD radical: OH regeneration

Baeza-Romero, M. Teresa, Glowacki, David R., Blitz, Mark A., Heard, Dwayne E., Pilling, Michael J., Rickard, Andrew R., Seakins, Paul W.

Journal:

Physical Chemistry Chemical Physics

Year:

2007

Language:

english

File:

PDF, 1.42 MB

english, 2007

20

Theory, measurements, and modeling of OH and HO2 formation in the reaction of cyclohexyl radicals with O2

Knepp, Adam M., Meloni, Giovanni, Jusinski, Leonard E., Taatjes, Craig A., Cavallotti, Carlo, Klippenstein, Stephen J.

Journal:

Physical Chemistry Chemical Physics

Year:

2007

Language:

english

File:

PDF, 1.55 MB

english, 2007

21

Photolysis of CH3C(O)CH3 (248 nm, 266 nm), CH3C(O)C2H5 (248 nm) and CH3C(O)Br (248 nm): pressure dependent quantum yields of CH3 formation

Khamaganov, V., Karunanandan, R., Rodriguez, A., Crowley, J. N.

Journal:

Physical Chemistry Chemical Physics

Year:

2007

Language:

english

File:

PDF, 1.61 MB

english, 2007

22

Temperature dependence of pentyl nitrate formation from the reaction of pentyl peroxy radicals with NO

Cassanelli, Paola, Fox, David J., Cox, R. Anthony

Journal:

Physical Chemistry Chemical Physics

Year:

2007

Language:

english

File:

PDF, 1.12 MB

english, 2007

23

Back cover

Journal:

Physical Chemistry Chemical Physics

Year:

2007

Language:

english

File:

PDF, 680 KB

english, 2007

24

Experimental and theoretical studies of the reaction of the OH radical with alkyl sulfides: 2. Kinetics and mechanism of the OH initiated oxidation of methylethyl and diethyl sulfides; observations of a two channel oxidation mechanism

Williams, M. B., Campuzano-Jost, P., Pounds, A. J., Hynes, A. J.

Journal:

Physical Chemistry Chemical Physics

Year:

2007

Language:

english

File:

PDF, 1.49 MB

english, 2007

25

A comparison of the reactivity of germylene and dimethylgermylene with some methylgermanes. Direct kinetic and quantum chemical studies

Becerra, Rosa, Boganov, Sergey E., Egorov, Mikhail P., Faustov, Valery I., Krylova, Irina V., Nefedov, Oleg M., Promyslov, Vladimir M., Walsh, Robin

Journal:

Physical Chemistry Chemical Physics

Year:

2007

Language:

english

File:

PDF, 1.28 MB

english, 2007

26

Kinetics and mechanism of the gas phase reaction of chlorine atoms with i-propanol

Yamanaka, T., Kawasaki, M., Hurley, M. D., Wallington, T. J., Schneider, W. F., Bruce, J.

Journal:

Physical Chemistry Chemical Physics

Year:

2007

Language:

english

File:

PDF, 1.26 MB

english, 2007

27

Wide temperature range (T = 295 K and 770–1305 K) study of the kinetics of the reactions HCO + NO and HCO + NO2 using frequency modulation spectroscopy

Dammeier, J., Colberg, M., Friedrichs, G.

Journal:

Physical Chemistry Chemical Physics

Year:

2007

Language:

english

File:

PDF, 1.55 MB

english, 2007

28

Kinetics and mechanism of the reactions of CH3CO and CH3C(O)CH2 radicals with O2. Low-pressure discharge flow experiments and quantum chemical computations

Kovács, Gergely, Zádor, Judit, Farkas, Edit, Nádasdi, Rebeka, Szilágyi, István, Dóbé, Sándor, Bérces, Tibor, Márta, Ferenc, Lendvay, György

Journal:

Physical Chemistry Chemical Physics

Year:

2007

Language:

english

File:

PDF, 1.21 MB

english, 2007

29

Shock tube study of dissociation and relaxation in 1,1-difluoroethane and vinyl fluoride

Xu, Hui, Kiefer, John H., Sivaramakrishnan, Raghu, Giri, Binod R., Tranter, Robert S.

Journal:

Physical Chemistry Chemical Physics

Year:

2007

Language:

english

File:

PDF, 1.79 MB

english, 2007

30

Inelastic scattering of OH(X 2Π) with Ar and He: a combined polarization spectroscopy and quantum scattering study

Marinakis, Sarantos, Paterson, Grant, Kłos, Jacek, Costen, Matthew L., McKendrick, Kenneth G.

Journal:

Physical Chemistry Chemical Physics

Year:

2007

Language:

english

File:

PDF, 1.38 MB

english, 2007

31

Vibrational relaxation of O2(X 3 Σ–g, v = 9–13) by collisions with O2

Watanabe, Shinji, Usuda, Shin-ya, Fujii, Hidekazu, Hatano, Hiroyuki, Tokue, Ikuo, Yamasaki, Katsuyoshi

Journal:

Physical Chemistry Chemical Physics

Year:

2007

Language:

english

File:

PDF, 1.23 MB

english, 2007

32

Is hydrogen abstraction an important pathway in the reaction of alkenes with the OH radical?

McGillen, Max R., Percival, Carl J., Shallcross, Dudley E., Harvey, Jeremy N.

Journal:

Physical Chemistry Chemical Physics

Year:

2007

Language:

english

File:

PDF, 1.10 MB

english, 2007

33

A kinetic study of the reactions of Ca+ ions with O3, O2, N2, CO2 and H2O

Broadley, Sarah L., Vondrak, Tomas, Plane, John M. C.

Journal:

Physical Chemistry Chemical Physics

Year:

2007

Language:

english

File:

PDF, 1.38 MB

english, 2007

34

The gas phase tropospheric removal of fluoroaldehydes (CxF2x+1CHO, x = 3, 4, 6)

Solignac, G., Mellouki, A., Le Bras, G., Yujing, Mu, Sidebottom, H.

Journal:

Physical Chemistry Chemical Physics

Year:

2007

Language:

english

File:

PDF, 1.48 MB

english, 2007

35

Reflected shock tube studies of high-temperature rate constants for OH + C2H2 and OH + C2H4

Srinivasan, N. K., Su, M.-C., Michael, J. V.

Journal:

Physical Chemistry Chemical Physics

Year:

2007

Language:

english

File:

PDF, 1.13 MB

english, 2007

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