Quantum mechanical modeling for the GeX₂/GeHX + GeH₄ reactions (X = H, F, Cl, and Br)

Chemistry

• Reaction Activation Energy 100%
• Gas Phase Reaction 100%
• Transition State 50%
• Rate Constant 50%
• Negative Activation Energy 50%
• Transition State Theory 50%
• Germanium 50%
• Molecular Structure 50%
• Singlet-Triplet Splitting 50%
• Germane 50%
• Hydrogen 50%

Keyphrases

• GeH4 100%
• Germylene 100%
• Quantum Mechanical Modeling 100%
• Activation Energy 40%
• Halo 40%
• Gas-phase Reactions 40%
• Molecular Structure 20%
• Transition State 20%
• Divalent 20%
• Negative Activation Energy 20%
• Transition State Theory 20%
• Time Rate 20%
• Germanium 20%
• Diffuse Functions 20%
• Tunneling Correction 20%
• Singlet-triplet Energy Gap (ΔEST) 20%