The calculated ICVT/SCT rate constant (k) and branching ratios (Γ) for SA scavenging ·NO2, at 298 K, in the gas phase and water phase, together with the available experimental value from [67].

Mass transfer of SCWO processes: Molecular diffusion and mass transfer coefficients of inorganic nitrate species in sub- and supercritical water

Goemans, M.G.E.
Gloyna, E.F.
Buelow, S.J.

April 1996

Molecular diffusion coefficients of lithium-, sodium-, potassium-, cesium-, calcium-, and strontium ...

Correction of Hydrate Dissociation in Shale Media via Correlation of Kim's Model

B. Mokhtari
M. Enayati
K. Pourabdollah

April 2009

Deep-sea gas hydrates are ice-like crystalline substances in which hydrocarbon and non-hydrocarbon g...

Results of Scoping Studies for Determining Radiolytic Hydrogen Production from Moist CST and CST Slurries

Bibler, N.E.

December 1998

In support of the Salt Disposition team, scoping studies have been performed on the radiolysis of mo...

The calculated ICVT/SCT rate constant (k) and branching ratios (Γ) for SA scavenging ·OH, at 298 K, in water phase, together with the available experimental values (kexp) from [70].

Yang Lu (59885)
AiHua Wang (406639)
Peng Shi (132534)
Hui Zhang (7197)
ZeSheng Li (770965)

September 2016

The calculated ICVT/SCT rate constant (k) and branching ratios (Γ) for SA scavenging ·OH, ...

The reaction enthalpies (ΔH), reaction Gibbs energies (ΔG) and energy barrier heights with ZPE corrections (ΔE+ZPE), at 298 K, for the reactions of SA with ·NO2 in the gas phase and water phase (in kJ/mol).

Yang Lu (59885)
AiHua Wang (406639)
Peng Shi (132534)
Hui Zhang (7197)
ZeSheng Li (770965)

September 2016

The reaction enthalpies (ΔH), reaction Gibbs energies (ΔG) and energy barrier heigh...

Kinetics of the C3H7O2 + NO reaction: Temperature dependence of the overall rate constant and the i-C3H7ONO2 branching channel

Chow, Jessica M.
Miller, Angela M.
Elrod, Matthew J.

May 2003

The temperature dependence of the overall rate constant for the C3H7O2 + NO reaction and the rate co...

Rate Constant and Branching Fraction for the NH2 + NO2 Reaction

Stephen J. Klippenstein (1292457)
Lawrence B. Harding (1292454)
Peter Glarborg (1267818)
Yide Gao (1566850)
Huanzhen Hu (1910155)
Paul Marshall (591182)

September 2013

The NH2 + NO2 reaction has been studied experimentally and theoretically. On t...

CCSD(T), W1, and other model chemistry predictions for gas-phase deprotonation reactions

Shields, George C.
Pickard, Frank C, IV
Griffith, Daniel R
Ferrara, Skylar J
Liptak, Matthew D
Kirschner, Karl N

January 2006

A series of CCSD(T) single-point calculations on MP4(SDQ) geometries and the W1 model chemistry meth...

Experimental and Theoretical Studies of Rate Coefficients for the Reaction O(3P) + C2H5OH at High Temperatures†

Chih-wei Wu
Shucheng Xu
M. C. Lin

January 2006

Rate coefficients of the reaction O(3P) + C2H5OH in the temperature range 782-1410 K were determined...

CCSD(T), W1, and Other Model Chemistry Predictions for Gas-Phase Deprotonation Reactions

Frank C. Pickard Iv
Daniel R. Griffith
Skylar J. Ferrara
Matthew D. Liptak
Karl N. Kirschner
George C. Shields

January 2006

ABSTRACT: A series of CCSD(T) single-point calculations on MP4(SDQ) geometries and the W1 model chem...

Theoretical and Experimental Studies of the Diketene System: Product Branching Decomposition Rate Constants and

Energetics Of Isomers
Binh Bui
Ti Jo Tsay
M. C. Lin
C. F. Melius

January 2007

ABSTRACT: The kinetics and mechanism for the thermal decomposition of diketene have been studied in ...

Application of a Scaled Homogeneous Nucleation-Rate Formalism to Experimental Data at T≪T\u3csub\u3ec\u3c/sub\u3e

Hale, Barbara N.

June 1986

It is pointed out that for temperatures T\u3c0.5Tc, where Tc is the critical temperature, the classi...

On the Temperature Dependence of the Rate Constant of the Bimolecular Reaction of two Hydrated Electrons

S.L. Butarbutar

It has been a longstanding issue in the radiation chemistry of water that, even though H2 is a molec...

Statistical Rate Theory Expression for Energy Transported during Evaporation

Persad, Aaron Harrinarine

November 2014

Statistical rate theory (SRT) uses the quantum-mechanical concept of state transition probabilities ...

Gas Phase Reaction of Silane with Water at Different Temperatures and Supported by Plasma

Maik Szafarska

April 2023

Data and Diagrams for "Gas Phase Reaction of Silane with Water at Different Temperatures and Support...

Mass transfer of SCWO processes: Molecular diffusion and mass transfer coefficients of inorganic nitrate species in sub- and supercritical water

Goemans, M.G.E.
Gloyna, E.F.
Buelow, S.J.

April 1996

Molecular diffusion coefficients of lithium-, sodium-, potassium-, cesium-, calcium-, and strontium ...

Correction of Hydrate Dissociation in Shale Media via Correlation of Kim's Model

B. Mokhtari
M. Enayati
K. Pourabdollah

April 2009

Deep-sea gas hydrates are ice-like crystalline substances in which hydrocarbon and non-hydrocarbon g...

Results of Scoping Studies for Determining Radiolytic Hydrogen Production from Moist CST and CST Slurries

Bibler, N.E.

December 1998

In support of the Salt Disposition team, scoping studies have been performed on the radiolysis of mo...

The calculated ICVT/SCT rate constant (k) and branching ratios (Γ) for SA scavenging ·OH, at 298 K, in water phase, together with the available experimental values (kexp) from [70].

Yang Lu (59885)
AiHua Wang (406639)
Peng Shi (132534)
Hui Zhang (7197)
ZeSheng Li (770965)

September 2016

The calculated ICVT/SCT rate constant (k) and branching ratios (Γ) for SA scavenging ·OH, ...

The reaction enthalpies (ΔH), reaction Gibbs energies (ΔG) and energy barrier heights with ZPE corrections (ΔE+ZPE), at 298 K, for the reactions of SA with ·NO2 in the gas phase and water phase (in kJ/mol).

Yang Lu (59885)
AiHua Wang (406639)
Peng Shi (132534)
Hui Zhang (7197)
ZeSheng Li (770965)

September 2016

The reaction enthalpies (ΔH), reaction Gibbs energies (ΔG) and energy barrier heigh...

Kinetics of the C3H7O2 + NO reaction: Temperature dependence of the overall rate constant and the i-C3H7ONO2 branching channel

Chow, Jessica M.
Miller, Angela M.
Elrod, Matthew J.

May 2003

The temperature dependence of the overall rate constant for the C3H7O2 + NO reaction and the rate co...

Rate Constant and Branching Fraction for the NH2 + NO2 Reaction

Stephen J. Klippenstein (1292457)
Lawrence B. Harding (1292454)
Peter Glarborg (1267818)
Yide Gao (1566850)
Huanzhen Hu (1910155)
Paul Marshall (591182)

September 2013

The NH2 + NO2 reaction has been studied experimentally and theoretically. On t...

CCSD(T), W1, and other model chemistry predictions for gas-phase deprotonation reactions

Shields, George C.
Pickard, Frank C, IV
Griffith, Daniel R
Ferrara, Skylar J
Liptak, Matthew D
Kirschner, Karl N

January 2006

A series of CCSD(T) single-point calculations on MP4(SDQ) geometries and the W1 model chemistry meth...

Experimental and Theoretical Studies of Rate Coefficients for the Reaction O(3P) + C2H5OH at High Temperatures†

Chih-wei Wu
Shucheng Xu
M. C. Lin

January 2006

Rate coefficients of the reaction O(3P) + C2H5OH in the temperature range 782-1410 K were determined...

CCSD(T), W1, and Other Model Chemistry Predictions for Gas-Phase Deprotonation Reactions

Frank C. Pickard Iv
Daniel R. Griffith
Skylar J. Ferrara
Matthew D. Liptak
Karl N. Kirschner
George C. Shields

January 2006

ABSTRACT: A series of CCSD(T) single-point calculations on MP4(SDQ) geometries and the W1 model chem...

Theoretical and Experimental Studies of the Diketene System: Product Branching Decomposition Rate Constants and

Energetics Of Isomers
Binh Bui
Ti Jo Tsay
M. C. Lin
C. F. Melius

January 2007

ABSTRACT: The kinetics and mechanism for the thermal decomposition of diketene have been studied in ...

Application of a Scaled Homogeneous Nucleation-Rate Formalism to Experimental Data at T≪T\u3csub\u3ec\u3c/sub\u3e

Hale, Barbara N.

June 1986

It is pointed out that for temperatures T\u3c0.5Tc, where Tc is the critical temperature, the classi...

On the Temperature Dependence of the Rate Constant of the Bimolecular Reaction of two Hydrated Electrons

S.L. Butarbutar

It has been a longstanding issue in the radiation chemistry of water that, even though H2 is a molec...

Statistical Rate Theory Expression for Energy Transported during Evaporation

Persad, Aaron Harrinarine

November 2014

Statistical rate theory (SRT) uses the quantum-mechanical concept of state transition probabilities ...

Gas Phase Reaction of Silane with Water at Different Temperatures and Supported by Plasma

Maik Szafarska

April 2023

Data and Diagrams for "Gas Phase Reaction of Silane with Water at Different Temperatures and Support...

Mass transfer of SCWO processes: Molecular diffusion and mass transfer coefficients of inorganic nitrate species in sub- and supercritical water

Goemans, M.G.E.
Gloyna, E.F.
Buelow, S.J.

April 1996

Molecular diffusion coefficients of lithium-, sodium-, potassium-, cesium-, calcium-, and strontium ...

Correction of Hydrate Dissociation in Shale Media via Correlation of Kim's Model

B. Mokhtari
M. Enayati
K. Pourabdollah

April 2009

Deep-sea gas hydrates are ice-like crystalline substances in which hydrocarbon and non-hydrocarbon g...

Results of Scoping Studies for Determining Radiolytic Hydrogen Production from Moist CST and CST Slurries

Bibler, N.E.

December 1998

In support of the Salt Disposition team, scoping studies have been performed on the radiolysis of mo...

The calculated ICVT/SCT rate constant (<i>k</i>) and branching ratios (Γ) for SA scavenging ·NO<sub>2</sub>, at 298 K, in the gas phase and water phase, together with the available experimental value from [67].

Abstract

Extracted data

The calculated ICVT/SCT rate constant (<i>k</i>) and branching ratios (Γ) for SA scavenging ·NO<sub>2</sub>, at 298 K, in the gas phase and water phase, together with the available experimental value from [67].

Abstract

Extracted data

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