Comparison of canonical variational transition state theory rate constants for H atom association with alkyl radicals and with the (111) surface of diamond

Engineering & Materials Science

• Association reactions 100%
• Atoms 51%
• Diamonds 49%
• Energy transfer 4%
• Lattice vibrations 7%
• Potential energy 4%
• Potential energy functions 6%
• Rate constants 61%
• Trajectories 2%

Chemistry

• Association Reaction 17%
• Diamond 47%
• Energy Parameter 7%
• Moment of Inertia 9%
• Partition Function 8%
• Potential Energy 6%
• Rate Constant 32%
• Reaction Path 13%
• Surface 15%
• Time 2%
• Transition State 10%
• Transition State Theory 59%
• Translational Energy 8%

Physics & Astronomy

• approximation 3%
• association reactions 19%
• atoms 25%
• diamonds 39%
• energy 1%
• energy transfer 5%
• kinetics 3%
• lattice vibrations 7%
• moments of inertia 7%
• partitions 5%
• potential energy 10%
• trajectories 4%