Chemistry
Molecular Dynamics
100%
Molecular Mechanic
75%
Quantum Mechanics
75%
Excited State
50%
Density Functional Theory
25%
X-Ray Scattering
25%
Excited Triplet State
25%
Solvent Effect
25%
Ground State
25%
Vibrational Relaxation
25%
Hartree-Fock Calculation
25%
Vibrational Energy
25%
Vibrational Energy Redistribution
25%
Potential Energy Surface
25%
Excited Electronic State
25%
Reaction Dynamics
25%
Excited Singlet State
25%
Structure
25%
Photocatalytic
25%
Coordination Compound
25%
Free Electron
25%
Physics
Molecular Dynamics
100%
Excitation
100%
Quantum Mechanics
75%
Transition Element
25%
X Ray Source
25%
Self Consistent Field
25%
X-Ray Free Electron Laser
25%
Density Functional Theory
25%
Structural Dynamics
25%
X Ray Scattering
25%
Ground State
25%
Transition Metal
25%
Potential Energy
25%
Molecular Relaxation
25%
Material Science
Photocatalysts
100%
Theoretical Modeling
100%
Surface Energy
100%
Coordination Compound
100%
Structural Dynamics
100%
Keyphrases
Born-Oppenheimer Molecular Dynamics Simulations
66%
Reaction Dynamics in Solution
33%
Configurational Sampling
33%
DFT Codes
33%
Dynamic Propagation
33%
Arbitrary Spin
33%
Scenario Theory
33%