Classical trajectory study of the dynamics of the reaction of Cl atoms with ethane

INIS

• dynamics 100%
• trajectories 100%
• energy 100%
• atoms 100%
• hamiltonians 100%
• ethane 100%
• levels 66%
• surfaces 66%
• hydrochloric acid 66%
• potential energy 66%
• electronic structure 66%
• information 33%
• distribution 33%
• prediction 33%
• geometry 33%
• collisions 33%
• ground states 33%
• harmonics 33%
• scattering 33%
• kinetic energy 33%

Chemistry

• Electronic State 100%
• Ethane 100%
• Potential Energy Surface 100%
• Ground State 50%
• Translational Energy 50%
• Coupled Cluster Singles and Doubles Theory 50%
• Kinetic Energy 50%
• Møller-Plesset Perturbation Theory 50%