Excited states of dna base pairs using long-range corrected time-dependent density functional theory

Chemistry

• Excited State 100%
• Time-Dependent Density Functional Theory 100%
• Pair-Base 100%
• Guanine 42%
• DFT-B3LYP Calculation 42%
• Cytosine 42%
• Adenine 42%
• Ground State 28%
• Deoxyribonucleic Acid 14%
• Density Functional Theory 14%
• Charge Transfer Transition 14%
• Local-Density Approximation 14%
• Coupled Cluster 14%

Engineering

• Excitation Energy 100%
• Ground State 100%
• Excited State 100%
• Illustrates 50%
• Computer Aided Manufacturing 50%
• Good Agreement 50%
• Functionals 50%

Keyphrases

• Exact Exchange 100%
• Non-optimum 50%
• Long-range Corrected Density Functional Theory 50%
• CAM-B3LYP 50%
• Attenuation Parameters 50%
• Excited-state Properties 50%
• Adenine-thymine 50%
• Adenine-thymine Base Pair 50%