Approximate Quantum Dynamics using Ab Initio Classical Separable Potentials: Spectroscopic Applications

Keyphrases

• Quantum Dynamics 100%
• Separable Potential 100%
• Spectroscopic Applications 100%
• Wave Function 66%
• Mean-field Potential 66%
• Amino Acids 33%
• Degrees of Freedom 33%
• Approximation Algorithms 33%
• Stretching Mode 33%
• Vibrational Modes 33%
• On the Fly 33%
• Large Molecules 33%
• Ab Initio Methods 33%
• Nucleobases 33%
• Line Shape 33%
• Ab Initio Molecular Dynamics Simulation 33%
• Effective Potential 33%
• Separability 33%
• Guanine-cytosine 33%
• Quantum Molecular Dynamics Simulation 33%
• Anharmonic Frequencies 33%
• Polyatomic System 33%
• System Calculations 33%

Chemistry

• Quantum Dynamics 100%
• Molecular Dynamics Simulation 100%
• Lineshape 50%
• Nuclear Wave Function 50%
• Nucleobase 50%
• Linewidth 50%
• Calculation Method 50%
• Amino Acid 50%
• Wave Function 50%
• Guanine 50%
• Cytosine 50%

Physics

• Wave Function 100%
• Molecular Dynamics 100%
• Linewidth 50%
• Method Ab Initio 50%
• Lineshape 50%
• Degree of Freedom 50%
• Amino Acid 50%