Direct molecular simulation of internal energy relaxation and dissociation in oxygen

Vibrational Energy Transfer and Collision-Induced Dissociation in O+O2 Collisions

(2019) Maninder S. Grover et al.   JOURNAL OF THERMOPHYSICS AND HEAT TRANSFER

Vibrational state-specific model for dissociation and recombination of the O2(  3Σg−)+O(  3P) system in DSMC

(2019) Tzu-Jung Pan et al.   JOURNAL OF CHEMICAL PHYSICS

Direct simulation Monte Carlo simulation of thermal fluctuations in gases

(2019) Domenico Bruno   PHYSICS OF FLUIDS

Potential energy surface of triplet O4

(2018) Yuliya Paukku et al.   JOURNAL OF CHEMICAL PHYSICS

Construction of a coarse-grain quasi-classical trajectory method. II. Comparison against the direct molecular simulation method

(2018) R. L. Macdonald et al.   JOURNAL OF CHEMICAL PHYSICS

Coupling of state-resolved rovibrational coarse-grain model for nitrogen to stochastic particle method for simulating internal energy excitation and dissociation

(2018) Erik Torres et al.   JOURNAL OF CHEMICAL PHYSICS

Potential energy surfaces of quintet and singlet O4

(2017) Yuliya Paukku et al.   JOURNAL OF CHEMICAL PHYSICS

Potential energy surfaces for O + O2 collisions

(2017) Zoltan Varga et al.   JOURNAL OF CHEMICAL PHYSICS

Adaptive coarse graining method for energy transfer and dissociation kinetics of polyatomic species

(2017) A. Sahai et al.   JOURNAL OF CHEMICAL PHYSICS

Direct Molecular Simulation of Nonequilibrium Dilute Gases

(2017) Thomas E. Schwartzentruber et al.   JOURNAL OF THERMOPHYSICS AND HEAT TRANSFER

DSMC study of oxygen shockwaves based on high-fidelity vibrational relaxation and dissociation models

(2017) Israel Borges Sebastião et al.   PHYSICS OF FLUIDS

Nonequilibrium internal energy distributions during dissociation

(2017) Narendra Singh et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Rovibrational energy transfer and dissociation in O2–O collisions

(2016) Daniil A. Andrienko et al.   JOURNAL OF CHEMICAL PHYSICS

Dynamics of nitrogen dissociation from direct molecular simulation

(2016) Paolo Valentini et al.   Physical Review Fluids

An improved potential energy surface and multi-temperature quasiclassical trajectory calculations of N2 + N2 dissociation reactions

(2015) Jason D. Bender et al.   JOURNAL OF CHEMICAL PHYSICS

Effect of O2 + O ab initio and Morse additive pairwise potentials on dissociation and relaxation rates for nonequilibrium flow calculations

(2015) Marat Kulakhmetov et al.   PHYSICS OF FLUIDS

Oxygen transport properties estimation by classical trajectory–direct simulation Monte Carlo

(2015) Domenico Bruno et al.   PHYSICS OF FLUIDS

Direct molecular simulation of nitrogen dissociation based on an ab initio potential energy surface

(2015) Paolo Valentini et al.   PHYSICS OF FLUIDS

Rovibrational coupling in molecular nitrogen at high temperature: An atomic-level study

(2014) Paolo Valentini et al.   PHYSICS OF FLUIDS

Rovibrational internal energy transfer and dissociation of N2(1Σg+)−N(4Su) system in hypersonic flows

(2013) Marco Panesi et al.   JOURNAL OF CHEMICAL PHYSICS

Investigation of oxygen dissociation and vibrational relaxation at temperatures 4000–10 800 K

(2013) L. B. Ibraguimova et al.   JOURNAL OF CHEMICAL PHYSICS

GPU-accelerated Classical Trajectory Calculation Direct Simulation Monte Carlo applied to shock waves

(2013) Paul Norman et al.   JOURNAL OF COMPUTATIONAL PHYSICS

Collisional radiative coarse-grain model for ionization in air

(2013) Marco Panesi et al.   PHYSICS OF FLUIDS

Kinetic model for multi-temperature flows of reacting carbon dioxide mixture

(2011) E.V. Kustova et al.   CHEMICAL PHYSICS

Coarse-grain model for internal energy excitation and dissociation of molecular nitrogen

(2011) Thierry E. Magin et al.   CHEMICAL PHYSICS

O–O2 state-to-state vibrational relaxation and dissociation rates based on quasiclassical calculations

(2008) Fabrizio Esposito et al.   CHEMICAL PHYSICS