Keyphrases
Proton-coupled Electron Transfer
89%
Benzoate
42%
Proton Transfer
38%
C-H Bond Cleavage
37%
Fluorenyl
37%
Proton Donor
33%
Pyridine
33%
State Interactions
33%
Anthracene
33%
Spin-orbit Coupling
33%
Donor-acceptor Distance
33%
Active Space
33%
Density Matrix Renormalization Group
29%
Potential Energy Surface
28%
Charge-separated State
24%
Inverted Region
21%
Carboxylate
21%
C-H Bond
21%
Electron Transfer
20%
Molecular Orbital
20%
Python
20%
Transport Properties
16%
G-tensor
16%
Tyrosine
16%
Complex Formation
16%
Inelastic Collisions
16%
Density Matrix Renormalization Group Method
16%
Ribonucleotide Reductase
16%
Automated Construction
16%
Structural Effect
16%
Momentum Transfer
16%
Low Temperature
16%
Photochemistry
16%
Elastic Collision
16%
Transport Complex
16%
Valence Orbital
16%
Collision Energy
16%
Radical Transfer
16%
Photoinduced
16%
Coupled Cluster
16%
Glutamate
16%
Electron Paramagnetic Resonance
16%
Double Proton Transfer
16%
Thermodynamic Effect
16%
Substituent Effect
16%
Program Package
16%
Variational Calculations
16%
Conjugated System
16%
Theory Calculation
16%
He-Ne
16%
Chemistry
Proton Transfer
73%
Electronic State
50%
Molecular Orbital
50%
Potential Energy Surface
38%
Anthracene
33%
Donor
33%
Excited State
29%
Ground State
29%
Rate Constant
28%
Flavin
28%
Spin-Orbit Coupling
25%
Perturbation Theory
21%
k·p perturbation theory
21%
Base
21%
Potential Energy
19%
Blue
18%
Molecular Dynamics
18%
Glutamic Acid
16%
Transport Property
16%
Benzene
16%
Coordination Compound
16%
EPR Spectroscopy
16%
Density Matrix
16%
Fenton Reaction
16%
Coupled Cluster
16%
Dipole Moment
16%
Chlordiazepoxide
16%
Multireference Method
16%
Electron Correlation
16%
Substituent Effect
16%
Coordination Compound
16%
Bipyridine
16%
Carbon Nanotube
16%
Ethylene
16%
Alkalinity
15%
Relaxation
14%
Momentum Transfer
11%
C-H Bond Activation
10%
Benzoate
10%
Transfer Reaction
9%
Equilibrium Constant
8%
