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The Journal of Physical Chemistry. A
|
January 28, 2021
How to VPT2: Accurate and Intuitive Simulations of CH Stretching Infrared Spectra Using VPT2+K with Large Effective Hamiltonian Resonance Treatments
Peter R Franke, John F Stanton, Gary E Douberly
The Journal of Chemical Physics
|
April 20, 2005
Approaching the basis set limit for transition metal compounds with highly polar bonds: a benchmark coupled-cluster study of the ScF3 and FeF3 molecular structures and spectra
Victor G Solomonik, John F Stanton, James E Boggs
The Journal of Physical Chemistry. A
|
March 23, 2019
Nonadiabatic Investigation of the Electronic Spectroscopy of trans-1,3-Butadiene
Scott M Rabidoux, Robert J Cave, John F Stanton
The Journal of Physical Chemistry. A
|
May 5, 2011
Ab initio reaction rate constants computed using semiclassical transition-state theory: HO + H2 → H2O + H and isotopologues
Thanh Lam Nguyen, John F Stanton, John R Barker
The Journal of Physical Chemistry. A
|
November 19, 2014
Relatively Selective Production of the Simplest Criegee Intermediate in a CH4/O2 Electric Discharge: Kinetic Analysis of a Plausible Mechanism
Thanh Lam Nguyen, Michael C McCarthy, John F Stanton
The Journal of Physical Chemistry. A
|
November 9, 2023
Relation Between Bond Angle and Carbon-Oxygen Stretching Frequencies in CO<sub>2</sub>-Containing Compounds
Madison M Foreman, John F Stanton, J Mathias Weber
The Journal of Physical Chemistry. A
|
May 5, 2026
Electronic Excitation Energies and Ionization Potentials with Sub-Chemical Accuracy from EOM-CC Composite Methods
Nitai P Sahoo, John F Stanton, Peter R Franke
The Journal of Physical Chemistry. A
|
February 3, 2012
Kinetic isotope effects for Cl + CH4 ⇌ HCl + CH3 calculated using ab initio semiclassical transition state theory
John R Barker, Thanh Lam Nguyen, John F Stanton
Organic Letters
|
July 28, 2006
Carbonyl coordination chemistry from a new angle: a computational study of alpha-carbon acidity based on electrophile coordination geometry
Ronald J T Houk, Eric V Anslyn, John F Stanton
Physical Chemistry Chemical Physics : PCCP
|
November 9, 2017
Theoretical investigation of the infrared spectrum of small polyynes
Kirstin D Doney, Dongfeng Zhao, John F Stanton, et al.
Page
of 23
Search research articles
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Showing results (51-60 of 228) with videos related to
Sort By:
Page
of 23
The Journal of Physical Chemistry. A
|
January 28, 2021
How to VPT2: Accurate and Intuitive Simulations of CH Stretching Infrared Spectra Using VPT2+K with Large Effective Hamiltonian Resonance Treatments
Peter R Franke, John F Stanton, Gary E Douberly
The Journal of Chemical Physics
|
April 20, 2005
Approaching the basis set limit for transition metal compounds with highly polar bonds: a benchmark coupled-cluster study of the ScF3 and FeF3 molecular structures and spectra
Victor G Solomonik, John F Stanton, James E Boggs
The Journal of Physical Chemistry. A
|
March 23, 2019
Nonadiabatic Investigation of the Electronic Spectroscopy of trans-1,3-Butadiene
Scott M Rabidoux, Robert J Cave, John F Stanton
The Journal of Physical Chemistry. A
|
May 5, 2011
Ab initio reaction rate constants computed using semiclassical transition-state theory: HO + H2 → H2O + H and isotopologues
Thanh Lam Nguyen, John F Stanton, John R Barker
The Journal of Physical Chemistry. A
|
November 19, 2014
Relatively Selective Production of the Simplest Criegee Intermediate in a CH4/O2 Electric Discharge: Kinetic Analysis of a Plausible Mechanism
Thanh Lam Nguyen, Michael C McCarthy, John F Stanton
The Journal of Physical Chemistry. A
|
November 9, 2023
Relation Between Bond Angle and Carbon-Oxygen Stretching Frequencies in CO<sub>2</sub>-Containing Compounds
Madison M Foreman, John F Stanton, J Mathias Weber
The Journal of Physical Chemistry. A
|
May 5, 2026
Electronic Excitation Energies and Ionization Potentials with Sub-Chemical Accuracy from EOM-CC Composite Methods
Nitai P Sahoo, John F Stanton, Peter R Franke
The Journal of Physical Chemistry. A
|
February 3, 2012
Kinetic isotope effects for Cl + CH4 ⇌ HCl + CH3 calculated using ab initio semiclassical transition state theory
John R Barker, Thanh Lam Nguyen, John F Stanton
Organic Letters
|
July 28, 2006
Carbonyl coordination chemistry from a new angle: a computational study of alpha-carbon acidity based on electrophile coordination geometry
Ronald J T Houk, Eric V Anslyn, John F Stanton
Physical Chemistry Chemical Physics : PCCP
|
November 9, 2017
Theoretical investigation of the infrared spectrum of small polyynes
Kirstin D Doney, Dongfeng Zhao, John F Stanton, et al.
Page
of 23