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Physical Chemistry Chemical Physics : PCCP
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October 9, 2015
Transition state geometry prediction using molecular group contributions
Pierre L Bhoorasingh, Richard H West
ACS Catalysis
|
May 23, 2024
Implementing the Blowers-Masel Approximation to Scale Activation Energy Based on Reaction Enthalpy in Mean-Field Microkinetic Modeling for Catalytic Methane Partial Oxidation
Chao Xu, Emily J Mazeau, Richard H West
The Journal of Physical Chemistry. C, Nanomaterials and Interfaces
|
October 23, 2024
Uncertainty Quantification of Linear Scaling, Machine Learning, and Density Functional Theory Derived Thermodynamics for the Catalytic Partial Oxidation of Methane on Rhodium
Christopher J Blais, Chao Xu, Richard H West
Faraday Discussions
|
May 1, 2026
An interpretable machine learning framework for prediction of adsorption energies and generative design of active sites on arbitrary catalysts
Matthew S Johnson, Richard H West, Judit Zádor
The Journal of Physical Chemistry. B
|
January 11, 2013
An extensible framework for capturing solvent effects in computer generated kinetic models
Amrit Jalan, Richard H West, William H Green
The Journal of Physical Chemistry. A
|
April 20, 2007
First-principles thermochemistry for the production of TiO2 from TiCl4
Richard H West, Gregory J O Beran, William H Green, et al.
The Journal of Physical Chemistry. A
|
November 6, 2009
First-principles thermochemistry for the combustion of a TiCl4 and AlCl3 mixture
Raphael Shirley, Yaoyao Liu, Tim S Totton, et al.
The Journal of Physical Chemistry. A
|
July 17, 2009
First-principles thermochemistry for silicon species in the decomposition of tetraethoxysilane
Weerapong Phadungsukanan, Shraddha Shekar, Raphael Shirley, et al.
The Journal of Physical Chemistry. A
|
August 19, 2017
Automated Transition State Theory Calculations for High-Throughput Kinetics
Pierre L Bhoorasingh, Belinda L Slakman, Fariba Seyedzadeh Khanshan, et al.
Journal of the Electrochemical Society
|
June 23, 2016
Double Potential Pulse Chronocoulometry for Detection of Plasma Membrane Cholesterol Efflux at Disk Platinum Microelectrodes
Richard H West, Hui Lu, Kendrick Shaw, et al.
Page
of 2
Search research articles
Search
Showing results (1-10 of 16) with videos related to
Sort By:
Page
of 2
Physical Chemistry Chemical Physics : PCCP
|
October 9, 2015
Transition state geometry prediction using molecular group contributions
Pierre L Bhoorasingh, Richard H West
ACS Catalysis
|
May 23, 2024
Implementing the Blowers-Masel Approximation to Scale Activation Energy Based on Reaction Enthalpy in Mean-Field Microkinetic Modeling for Catalytic Methane Partial Oxidation
Chao Xu, Emily J Mazeau, Richard H West
The Journal of Physical Chemistry. C, Nanomaterials and Interfaces
|
October 23, 2024
Uncertainty Quantification of Linear Scaling, Machine Learning, and Density Functional Theory Derived Thermodynamics for the Catalytic Partial Oxidation of Methane on Rhodium
Christopher J Blais, Chao Xu, Richard H West
Faraday Discussions
|
May 1, 2026
An interpretable machine learning framework for prediction of adsorption energies and generative design of active sites on arbitrary catalysts
Matthew S Johnson, Richard H West, Judit Zádor
The Journal of Physical Chemistry. B
|
January 11, 2013
An extensible framework for capturing solvent effects in computer generated kinetic models
Amrit Jalan, Richard H West, William H Green
The Journal of Physical Chemistry. A
|
April 20, 2007
First-principles thermochemistry for the production of TiO2 from TiCl4
Richard H West, Gregory J O Beran, William H Green, et al.
The Journal of Physical Chemistry. A
|
November 6, 2009
First-principles thermochemistry for the combustion of a TiCl4 and AlCl3 mixture
Raphael Shirley, Yaoyao Liu, Tim S Totton, et al.
The Journal of Physical Chemistry. A
|
July 17, 2009
First-principles thermochemistry for silicon species in the decomposition of tetraethoxysilane
Weerapong Phadungsukanan, Shraddha Shekar, Raphael Shirley, et al.
The Journal of Physical Chemistry. A
|
August 19, 2017
Automated Transition State Theory Calculations for High-Throughput Kinetics
Pierre L Bhoorasingh, Belinda L Slakman, Fariba Seyedzadeh Khanshan, et al.
Journal of the Electrochemical Society
|
June 23, 2016
Double Potential Pulse Chronocoulometry for Detection of Plasma Membrane Cholesterol Efflux at Disk Platinum Microelectrodes
Richard H West, Hui Lu, Kendrick Shaw, et al.
Page
of 2