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Physical Chemistry Chemical Physics : PCCP|March 2, 2026
Calculating liquid-phase entropy using a real gas model within the QM/PCM frameworkYu-Ichiro Izato, Mitsuo KoshiThe Journal of Physical Chemistry. B|April 4, 2017
Initial Decomposition Pathways of Aqueous Hydroxylamine SolutionsYu-Ichiro Izato, Mitsuo Koshi, Atsumi MiyakePhysical Chemistry Chemical Physics : PCCP|August 9, 2024
Computation of rate coefficients in solutions based on transition state theory combined with a heuristically corrected polarizable continuum model: intermolecular Diels-Alder reactions as case studiesYu-Ichiro Izato, Mitsuo Koshi, Atsumi MiyakePhysical Chemistry Chemical Physics : PCCP|March 6, 2023
Computation of entropy values for non-electrolyte solute molecules in solution based on semi-empirical corrections to a polarized continuum modelYu-Ichiro Izato, Akira Matsugi, Mitsuo Koshi, et al.Physical Chemistry Chemical Physics : PCCP|August 28, 2019
A simple heuristic approach to estimate the thermochemistry of condensed-phase molecules based on the polarizable continuum modelYu-Ichiro Izato, Akira Matsugi, Mitsuo Koshi, et al.The Journal of Physical Chemistry. A|May 6, 2022
Detailed Kinetic Model for the Thermal Decomposition of Hydrazine Nitrate in Nitric Acid Solution Based on Quantum Chemistry Calculations Combined with the Polarizable Continuum ModelYu-Ichiro Izato, Kento Shiota, Atsumi MiyakePhysical Review Letters|March 4, 2017
Direct Self-Sustained Fragmentation Cascade of Reactive DropletsChihiro Inoue, Yu-Ichiro Izato, Atsumi Miyake, et al.Analytical Chemistry|May 16, 2012
Importance of fundamental sp, sp2, and sp3 hydrocarbon radicals in the growth of polycyclic aromatic hydrocarbonsBikau Shukla, Mitsuo KoshiThe Journal of Physical Chemistry. B|September 15, 2006
Theoretical studies of energy transfer rates of secondary explosivesShuji Ye, Mitsuo KoshiPhysical Chemistry Chemical Physics : PCCP|May 8, 2010
A highly efficient growth mechanism of polycyclic aromatic hydrocarbonsBikau Shukla, Mitsuo KoshiPageof 3