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Title: Exploring mechanisms of a tropospheric archetype: CH3O2 + NO

Authors:
 [1];  [1];  [1]
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  1. Center for Computational Quantum Chemistry, University of Georgia, Athens, Georgia 30602, USA
Publication Date:
Sponsoring Org.:
USDOE
OSTI Identifier:
1229795
Grant/Contract Number:  
FG02-97-ER14748
Resource Type:
Publisher's Accepted Manuscript
Journal Name:
The Journal of Chemical Physics
Additional Journal Information:
Journal Name: The Journal of Chemical Physics Journal Volume: 143 Journal Issue: 23; Journal ID: ISSN 0021-9606
Publisher:
American Institute of Physics
Country of Publication:
United States
Language:
English

Citation Formats

Launder, Andrew M., Agarwal, Jay, and Schaefer, III, Henry F. Exploring mechanisms of a tropospheric archetype: CH3O2 + NO. United States: N. p., 2015. Web. doi:10.1063/1.4937381.
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Launder, Andrew M., Agarwal, Jay, & Schaefer, III, Henry F. Exploring mechanisms of a tropospheric archetype: CH3O2 + NO. United States. doi:10.1063/1.4937381.
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Launder, Andrew M., Agarwal, Jay, and Schaefer, III, Henry F. Tue . "Exploring mechanisms of a tropospheric archetype: CH3O2 + NO". United States. doi:10.1063/1.4937381.
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@article{osti_1229795,
title = {Exploring mechanisms of a tropospheric archetype: CH3O2 + NO},
author = {Launder, Andrew M. and Agarwal, Jay and Schaefer, III, Henry F.},
abstractNote = {},
doi = {10.1063/1.4937381},
journal = {The Journal of Chemical Physics},
number = 23,
volume = 143,
place = {United States},
year = {2015},
month = {12}
}
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DOI: 10.1063/1.4937381
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Works referenced in this record:

Exploring mechanisms of a tropospheric archetype: CH3O2 + NO
journal, December 2015

  • Launder, Andrew M.; Agarwal, Jay; Schaefer, Henry F.
  • The Journal of Chemical Physics, Vol. 143, Issue 23
  • DOI: 10.1063/1.4937381

Effects of temperature and pressure on alkyl nitrate yields in the nitrogen oxide (NOx) photooxidations of n-pentane and n-heptane
journal, May 1983

  • Atkinson, Roger; Carter, William P. L.; Winer, Arthur M.
  • The Journal of Physical Chemistry, Vol. 87, Issue 11
  • DOI: 10.1021/j100234a034

Photo-oxidation of methane in the presence of NO and NO2
journal, January 1976

  • Cox, Richard A.; Derwent, Richard G.; Holt, Pauline M.
  • Journal of the Chemical Society, Faraday Transactions 1: Physical Chemistry in Condensed Phases, Vol. 72, Issue 0
  • DOI: 10.1039/f19767202044

Kinetics of the CH 3 O 2 + NO Reaction:  Temperature Dependence of the Overall Rate Constant and an Improved Upper Limit for the CH 3 ONO 2 Branching Channel
journal, June 1999

  • Scholtens, Kurtis W.; Messer, Benjamin M.; Cappa, Christopher D.
  • The Journal of Physical Chemistry A, Vol. 103, Issue 22
  • DOI: 10.1021/jp990469k

Proton Affinity of Methyl Nitrite and Methyl Peroxynitrite: Implications for Measuring Branching Ratios of Alkyl Nitrates and Nitrites
journal, August 2008

  • Ravelo, Rose M.; Francisco, Joseph S.
  • Journal of the American Chemical Society, Vol. 130, Issue 33
  • DOI: 10.1021/ja8045662

Rate Constants and Kinetic Isotope Effects for Methoxy Radical Reacting with NO 2 and O 2
journal, May 2014

  • Chai, Jiajue; Hu, Hongyi; Dibble, Theodore S.
  • The Journal of Physical Chemistry A, Vol. 118, Issue 20
  • DOI: 10.1021/jp501205d

NO2 quantum yields from ultraviolet photodissociation of methyl and isopropyl nitrate
journal, January 2010

  • Carbajo, Paula Gorrotxategi; Orr-Ewing, Andrew J.
  • Physical Chemistry Chemical Physics, Vol. 12, Issue 23
  • DOI: 10.1039/c001425g

Phytotoxicity of air pollutants formed by high explosive production
journal, October 1979

  • Thompson, C. Ray; Kats, Gerrit; Lennox, Robert W.
  • Environmental Science & Technology, Vol. 13, Issue 10
  • DOI: 10.1021/es60158a004

Alkyl nitrate formation from the atmospheric photoxidation of alkanes; a revised estimation method
journal, February 1989

  • Carter, William P. L.; Atkinson, Roger
  • Journal of Atmospheric Chemistry, Vol. 8, Issue 2
  • DOI: 10.1007/BF00053721

Approximate treatment of higher excitations in coupled-cluster theory
journal, December 2005

  • Kállay, Mihály; Gauss, Jürgen
  • The Journal of Chemical Physics, Vol. 123, Issue 21
  • DOI: 10.1063/1.2121589

Gas-Phase Tropospheric Chemistry of Volatile Organic Compounds: 1. Alkanes and Alkenes
journal, March 1997

  • Atkinson, R.
  • Journal of Physical and Chemical Reference Data, Vol. 26, Issue 2
  • DOI: 10.1063/1.556012

Application of an equation-of-motion coupled cluster method including higher-order corrections to potential energy surfaces of radicals
journal, November 1999

  • Saeh, Jamal C.; Stanton, John F.
  • The Journal of Chemical Physics, Vol. 111, Issue 18
  • DOI: 10.1063/1.480171

Atmospheric chemistry of VOCs and NOx
journal, January 2000

Peroxyacetyl radical: Electronic excitation energies, fundamental vibrational frequencies, and symmetry breaking in the first excited state
journal, February 2015

  • Copan, Andreas V.; Wiens, Avery E.; Nowara, Ewa M.
  • The Journal of Chemical Physics, Vol. 142, Issue 5
  • DOI: 10.1063/1.4906490

Rate constants for reactions of CH3O2 in the gas phase
journal, August 1979

Hartree–Fock orbital instability envelopes in highly correlated single-reference wave functions
journal, December 1997

  • Crawford, T. Daniel; Stanton, John F.; Allen, Wesley D.
  • The Journal of Chemical Physics, Vol. 107, Issue 24
  • DOI: 10.1063/1.474178

Mechanistic and dynamic investigations for multi-channel reaction of CH3O2+NO
journal, July 2005

Why CCSD(T) works: a different perspective
journal, December 1997

Kinetics of the reaction of CH3O with NO2
journal, March 1985

The diagonal correction to the Born–Oppenheimer approximation: Its effect on the singlet–triplet splitting of CH 2 and other molecular effects
journal, April 1986

  • Handy, Nicholas C.; Yamaguchi, Yukio; Schaefer, Henry F.
  • The Journal of Chemical Physics, Vol. 84, Issue 8
  • DOI: 10.1063/1.450020

Perturbative corrections to account for triple excitations in closed and open shell coupled cluster theories
journal, September 1994

Definitive Ab Initio Studies of Model SN2 Reactions CH3X+F (X=F, Cl, CN, OH, SH, NH2, PH2)
journal, May 2003

  • Gonzales, Jason M.; Pak, Chaeho; Cox, R. Sidney
  • Chemistry - A European Journal, Vol. 9, Issue 10
  • DOI: 10.1002/chem.200204408

Direct Evidence for a Marine Source of C1 and C2 Alkyl Nitrates
journal, August 2002

Role of Conformation of Peroxynitrite Anion (ONOO-) with Its Stability and Toxicity
journal, May 1994

  • Tsai, Jyh-Hsin M.; Harrison, Joseph G.; Martin, James C.
  • Journal of the American Chemical Society, Vol. 116, Issue 9
  • DOI: 10.1021/ja00088a072

Kinetics of the Reaction of CH 3 O 2 + NO:  A Temperature and Pressure Dependence Study with Chemical Ionization Mass Spectrometry
journal, December 2004

  • Bacak, Asan; Bardwell, Max W.; Raventos, M. Teresa
  • The Journal of Physical Chemistry A, Vol. 108, Issue 48
  • DOI: 10.1021/jp047764b

Reaction of Organic Peroxyl Radicals with • NO 2 and • NO in Aqueous Solution:  Intermediacy of Organic Peroxynitrate and Peroxynitrite Species
journal, March 2004

  • Goldstein, Sara; Lind, Johan; Merenyi, Gabor
  • The Journal of Physical Chemistry A, Vol. 108, Issue 10
  • DOI: 10.1021/jp037431z

Rate constant for the reaction of CH3O2 with NO
journal, February 1994

Investigation into the pressure dependence between 1 and 10 Torr of the reactions of NO2 with CH3 and CH3O
journal, January 1993

  • Biggs, Peter; Canosa-Mas, Carlos E.; Fracheboud, Jean-Marc
  • Journal of the Chemical Society, Faraday Transactions, Vol. 89, Issue 23
  • DOI: 10.1039/ft9938904163

Non-RRKM Dynamics in the CH 3 O 2 + NO Reaction System
journal, March 2008

  • Stimac, Philip J.; Barker, John R.
  • The Journal of Physical Chemistry A, Vol. 112, Issue 12
  • DOI: 10.1021/jp710016n

Mechanism of the Reaction of CH 3 SO with NO 2 in Relation to Atmospheric Oxidation of Dimethyl Sulfide:  Experimental and Theoretical Study
journal, February 2000

  • Kukui, Alexander; Bossoutrot, Valérie; Laverdet, Gérard
  • The Journal of Physical Chemistry A, Vol. 104, Issue 5
  • DOI: 10.1021/jp993158i

Rate coefficient for the reaction of methyldioxy radicals with nitric oxide from 218 to 365 K
journal, October 1981

  • Simonaitis, R.; Heicklen, Julian
  • The Journal of Physical Chemistry, Vol. 85, Issue 20
  • DOI: 10.1021/j150620a020

Approximate relativistic corrections to atomic radial wave functions*
journal, January 1976

  • Cowan, Robert D.; Griffin, Donald C.
  • Journal of the Optical Society of America, Vol. 66, Issue 10
  • DOI: 10.1364/JOSA.66.001010

Absolute rate constants for the reaction of NO with a series of peroxy radicals in the gas phase at 295 K
journal, October 1993

A Temperature-Dependent Kinetics Study of the CH3O2 + NO Reaction Using Chemical Ionization Mass Spectrometry
journal, August 1995

  • Villalta, Peter W.; Huey, L. Gregory; Howard, Carleton J.
  • The Journal of Physical Chemistry, Vol. 99, Issue 34
  • DOI: 10.1021/j100034a023

Selectivity and Mechanisms Driven by Reaction Dynamics: The Case of the Gas-Phase OH – + CH 3 ONO 2 Reaction
journal, November 2012

  • de Souza, Miguel A. F.; Correra, Thiago C.; Riveros, José M.
  • Journal of the American Chemical Society, Vol. 134, Issue 46
  • DOI: 10.1021/ja3057166

The Role of NO and NO2 in the Chemistry of the Troposphere and Stratosphere
journal, May 1979

Relativistic effects at the correlated level. An application to interhalogens
journal, December 1993

Pressure and Temperature Dependence of Methyl Nitrate Formation in the CH 3 O 2 + NO Reaction
journal, February 2012

  • Butkovskaya, Nadezhda; Kukui, Alexandre; Le Bras, Georges
  • The Journal of Physical Chemistry A, Vol. 116, Issue 24
  • DOI: 10.1021/jp210710d

Kinetics studies of the reactions of methyldioxy with nitric oxide, nitrogen dioxide, and methyldioxy at 298 K
journal, June 1980

  • Sander, S. P.; Watson, R. T.
  • The Journal of Physical Chemistry, Vol. 84, Issue 13
  • DOI: 10.1021/j100450a002

Thermal decomposition pathways for peroxyacetyl nitrate (PAN): Implications for atmospheric methyl nitrate levels
journal, December 1992

  • Orlando, John J.; Tyndall, Geoffrey S.; Calvert, Jack G.
  • Atmospheric Environment. Part A. General Topics, Vol. 26, Issue 17
  • DOI: 10.1016/0960-1686(92)90468-Z

Reactions of methylperoxy radicals with nitric oxide and nitrogen dioxide
journal, January 1973

  • Spicer, Chester W.; Villa, Alberto.; Wiebe, H. A.
  • Journal of the American Chemical Society, Vol. 95, Issue 1
  • DOI: 10.1021/ja00782a003

Photolysis of methyl nitrite in the presence of nitric oxide, nitrogen dioxide, and oxygen
journal, January 1973

  • Wiebe, H. A.; Villa, Alberto.; Hellman, T. M.
  • Journal of the American Chemical Society, Vol. 95, Issue 1
  • DOI: 10.1021/ja00782a002

Theoretical studies of atmospheric reaction mechanisms in the troposphere
journal, January 2012

  • Vereecken, Luc; Francisco, Joseph S.
  • Chemical Society Reviews, Vol. 41, Issue 19
  • DOI: 10.1039/c2cs35070j

Gas-Phase Nucleophilic and Elimination Reactions in Simple Alkyl Nitrates
journal, November 2010

  • Correra, Thiago C.; Riveros, José M.
  • The Journal of Physical Chemistry A, Vol. 114, Issue 44
  • DOI: 10.1021/jp107500s

Triplet instability in doublet systems
journal, January 2004

  • Szalay, Péter G.; Vázquez, Juana; Simmons, Chris
  • The Journal of Chemical Physics, Vol. 121, Issue 16
  • DOI: 10.1063/1.1795153

The adiabatic correction to molecular potential surfaces in the SCF approximation
journal, January 1984

Temperature dependence of the limiting low- and high-pressure rate constants for the CH3O+NO2+He reaction over the 250–390 K temperature range
journal, October 2000

The mechanism of SO2 oxidation by CH3O2 radicals. Rate coefficients for the reactions of CH3O2 with SO2 and NO
journal, August 1979

Rate constants for the reactions of CH3O2 with HO2, NO and NO2 using molecular modulation spectrometry
journal, January 1980

  • Cox, Richard A.; Tyndall, Geoffrey S.
  • Journal of the Chemical Society, Faraday Transactions 2, Vol. 76
  • DOI: 10.1039/f29807600153

Open-shell analytical energy gradients for triple excitation many-body, coupled-cluster methods: MBPT(4), CCSD+T(CCSD), CCSD(T),and QCISD(T)
journal, November 1992

Coupled-cluster theory, pseudo-Jahn–Teller effects and conical intersections
journal, January 2001

  • Stanton, John F.
  • The Journal of Chemical Physics, Vol. 115, Issue 22
  • DOI: 10.1063/1.1416176

Kinetic spectroscopy study of the reaction of CH3O2 with NO
journal, June 1979

A comparison of the efficiency and accuracy of the quadratic configuration interaction (QCISD), coupled cluster (CCSD), and Brueckner coupled cluster (BCCD) methods
journal, February 1992

Theoretical study on the mechanism of the gas-phase radical–radical reaction of CH3O with NO2
journal, June 2005

In pursuit of the ab initio limit for conformational energy prototypes
journal, June 1998

  • Császár, Attila G.; Allen, Wesley D.; Schaefer, Henry F.
  • The Journal of Chemical Physics, Vol. 108, Issue 23
  • DOI: 10.1063/1.476449

Kinetics of the reaction of CH 3 O 2 with NO
journal, February 1981

  • Ravishankara, A. R.; Eisele, F. L.; Kreutter, N. M.
  • The Journal of Chemical Physics, Vol. 74, Issue 4
  • DOI: 10.1063/1.441343

Organic peroxy radicals: Kinetics, spectroscopy and tropospheric chemistry
journal, July 1992

  • Lightfoot, P. D.; Cox, R. A.; Crowley, J. N.
  • Atmospheric Environment. Part A. General Topics, Vol. 26, Issue 10
  • DOI: 10.1016/0960-1686(92)90423-I

Higher excitations in coupled-cluster theory
journal, August 2001

  • Kállay, Mihály; Surján, Péter R.
  • The Journal of Chemical Physics, Vol. 115, Issue 7
  • DOI: 10.1063/1.1383290

Gaussian basis sets for use in correlated molecular calculations. I. The atoms boron through neon and hydrogen
journal, January 1989

  • Dunning, Thom H.
  • The Journal of Chemical Physics, Vol. 90, Issue 2
  • DOI: 10.1063/1.456153

Flash photolysis study of the spectra of CH3O2 and C(CH3)3O2 radicals and the kinetics of their mutual reactions and with NO
journal, January 1978

  • Anastasi, Christopher; Smith, Ian W. M.; Parkes, David A.
  • Journal of the Chemical Society, Faraday Transactions 1: Physical Chemistry in Condensed Phases, Vol. 74, Issue 0
  • DOI: 10.1039/f19787401693

Quantum Mechanical Investigation of the Atmospheric Reaction CH 3 O 2 + NO
journal, June 2006

  • Lesar, Antonija; Hodošček, Milan; Drougas, Evangelos
  • The Journal of Physical Chemistry A, Vol. 110, Issue 25
  • DOI: 10.1021/jp0614244

Modeling the Organic Nitrate Yields in the Reaction of Alkyl Peroxy Radicals with Nitric Oxide. 2. Reaction Simulations
journal, September 2003

  • Barker, John R.; Lohr, Lawrence L.; Shroll, Robert M.
  • The Journal of Physical Chemistry A, Vol. 107, Issue 38
  • DOI: 10.1021/jp034638j

Reactions of methylperoxy radicals with nitric oxide and nitrogen dioxide
journal, November 1974

  • Simonaitis, R.; Heicklen, Julian
  • The Journal of Physical Chemistry, Vol. 78, Issue 24
  • DOI: 10.1021/j100617a001

Accurate electrical and spectroscopic properties ofX 1?+ BeO from coupled-cluster methods
journal, March 1995

  • Watts, John D.; Urban, Miroslav; Bartlett, Rodney J.
  • Theoretica Chimica Acta, Vol. 90, Issue 5-6
  • DOI: 10.1007/BF01113541

Coupled-cluster methods including noniterative corrections for quadruple excitations
journal, August 2005

  • Bomble, Yannick J.; Stanton, John F.; Kállay, Mihály
  • The Journal of Chemical Physics, Vol. 123, Issue 5
  • DOI: 10.1063/1.1950567

Approach to the Atmospheric Chemistry of Methyl Nitrate and Methylperoxy Nitrite. Chemical Mechanisms of Their Formation and Decomposition Reactions in the Gas Phase
journal, January 2008

  • Arenas, Juan F.; Avila, Francisco J.; Otero, Juan C.
  • The Journal of Physical Chemistry A, Vol. 112, Issue 2
  • DOI: 10.1021/jp075546n

The reaction of methoxy radicals with nitric oxide and nitrogen dioxide
journal, November 1979

  • Batt, L.; Rattray, G. N.
  • International Journal of Chemical Kinetics, Vol. 11, Issue 11
  • DOI: 10.1002/kin.550111105

Mechanisms of Peroxynitrous Acid and Methyl Peroxynitrite, ROONO (R = H, Me), Rearrangements:  A Conformation-Dependent Homolytic Dissociation
journal, July 2004

  • Zhao, Yilei; Houk, K. N.; Olson, Leif P.
  • The Journal of Physical Chemistry A, Vol. 108, Issue 27
  • DOI: 10.1021/jp048661w

Gas-phase radical chemistry in the troposphere
journal, January 2005

  • Monks, Paul S.
  • Chemical Society Reviews, Vol. 34, Issue 5
  • DOI: 10.1039/b307982c

Kinetic Investigations of the Reactions of CD 3 O 2 with NO and NO 3 at 298 K
journal, January 1996

  • Helleis, Frank; Moortgat, Geert K.; Crowley, John N.
  • The Journal of Physical Chemistry, Vol. 100, Issue 45
  • DOI: 10.1021/jp961059o

Rate constants for the reactions of CH3O and C2H5O with NO2 over a range of temperature and total pressure
journal, January 1990

  • Frost, Michael J.; Smith, Ian W. M.
  • Journal of the Chemical Society, Faraday Transactions, Vol. 86, Issue 10
  • DOI: 10.1039/ft9908601751

Gas-phase tropospheric chemistry of organic compounds: A review
journal, January 1990

Rate coefficient for the reaction of methyldioxy with nitric oxide at 295 K
journal, October 1981

  • Plumb, I. C.; Ryan, K. R.; Steven, J. R.
  • The Journal of Physical Chemistry, Vol. 85, Issue 21
  • DOI: 10.1021/j150621a026

The very-low-pressure pyrolysis (VLPP) ofn-propyl nitrate,tert-butyl nitrite, and methyl nitrite. Rate constants for some alkoxy radical reactions
journal, September 1975

  • Mendenhall, G. David; Golden, David M.; Benson, Sidney W.
  • International Journal of Chemical Kinetics, Vol. 7, Issue 5
  • DOI: 10.1002/kin.550070509

On the Mechanism for Nitrate Formation via the Peroxy Radical + NO Reaction
journal, October 2004

  • Zhang, Jieyuan; Dransfield, Tim; Donahue, Neil M.
  • The Journal of Physical Chemistry A, Vol. 108, Issue 42
  • DOI: 10.1021/jp048096x

Reactions of Methyl- and Ethylperoxy Radicals with NO Studied by Time-Resolved Negative Ionization Mass Spectrometry
journal, November 2004

  • Xing, Jia-Hua; Nagai, Yoko; Kusuhara, Masayuki
  • The Journal of Physical Chemistry A, Vol. 108, Issue 47
  • DOI: 10.1021/jp0480347

Open‐shell coupled‐cluster theory
journal, June 1993

  • Jayatilaka, Dylan; Lee, Timothy J.
  • The Journal of Chemical Physics, Vol. 98, Issue 12
  • DOI: 10.1063/1.464352

General atomic and molecular electronic structure system
journal, November 1993

  • Schmidt, Michael W.; Baldridge, Kim K.; Boatz, Jerry A.
  • Journal of Computational Chemistry, Vol. 14, Issue 11, p. 1347-1363
  • DOI: 10.1002/jcc.540141112

Gaussian basis sets for use in correlated molecular calculations. V. Core‐valence basis sets for boron through neon
journal, September 1995

  • Woon, David E.; Dunning, Thom H.
  • The Journal of Chemical Physics, Vol. 103, Issue 11
  • DOI: 10.1063/1.470645

Modeling the Organic Nitrate Yields in the Reaction of Alkyl Peroxy Radicals with Nitric Oxide. 1. Electronic Structure Calculations and Thermochemistry
journal, September 2003

  • Lohr, Lawrence L.; Barker, John R.; Shroll, Robert M.
  • The Journal of Physical Chemistry A, Vol. 107, Issue 38
  • DOI: 10.1021/jp034637r

The torsional conformations of butane: Definitive energetics from ab initio methods
journal, March 1997

  • Allinger, Norman L.; Fermann, Justin T.; Allen, Wesley D.
  • The Journal of Chemical Physics, Vol. 106, Issue 12
  • DOI: 10.1063/1.473993

Long path infrared spectroscopic study of the reaction of methylperoxy free radicals with nitric oxide
journal, October 1974

  • Pate, C. T.; Finlayson, B. J.; Pitts, J. N.
  • Journal of the American Chemical Society, Vol. 96, Issue 21
  • DOI: 10.1021/ja00828a003

Kinetics of the reaction of CH3O2 with NO
journal, May 1979

Atmospheric composition change – global and regional air quality
journal, October 2009

A diagnostic for determining the quality of single-reference electron correlation methods
journal, April 1989

  • Lee, Timothy J.; Taylor, Peter R.
  • International Journal of Quantum Chemistry, Vol. 36, Issue S23
  • DOI: 10.1002/qua.560360824

The decomposition of dimethyl peroxide and the rate constant for CH3O + O2 ? CH2O + HO2
journal, January 1977

  • Barker, John R.; Benson, Sidney W.; Golden, David M.
  • International Journal of Chemical Kinetics, Vol. 9, Issue 1
  • DOI: 10.1002/kin.550090105

1285. Reactions of methoxyl, ethoxyl, and t-butoxyl with nitric oxide and with nitrogen dioxide
journal, January 1965

Basis-set convergence of correlated calculations on water
journal, June 1997

  • Helgaker, Trygve; Klopper, Wim; Koch, Henrik
  • The Journal of Chemical Physics, Vol. 106, Issue 23
  • DOI: 10.1063/1.473863

Assessment of density-functionals for describing the X − + CH 3 ONO 2 gas-phase reactions with X = F, OH, CH 2 CN
journal, January 2014

  • Proenza, Yaicel G.; de Souza, Miguel A. F.; Ventura, Elizete
  • Phys. Chem. Chem. Phys., Vol. 16, Issue 48
  • DOI: 10.1039/C4CP03674C

Reactions of methyl and methoxyl radicals with nitrogen dioxide and nitric oxide
journal, January 1965

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