Describing transition metal homogeneous catalysis using the random phase approximation

Keyphrases

• Random Phase Approximation 100%
• Homogeneous Catalysis 100%
• Transition Metal Chemistry 33%
• Complementary Method 16%
• Reaction Energy 16%
• Basis Set Convergence 16%
• Density Functional Theory 16%
• Large Systems 16%
• Approximation Methods 16%
• Bond Activation 16%
• Dispersion-corrected Density Functional Theory (DFT-D) 16%
• Phosphane Ligands 16%
• Maximum Deviation 16%
• Ruthenium Catalyst 16%
• Electronic Energy 16%
• Chloride Bridge 16%
• Olefin Metathesis 16%
• Convergence Behavior 16%
• Rhodium 16%
• DLPNO-CCSD(T) 16%
• Coupled Cluster Method 16%
• Local Pairs 16%

Chemistry

• Random Phase Approximation 100%
• Homogeneous Catalysis 100%
• Transition Metal 100%
• Density Functional Theory 33%
• Ruthenium 16%
• Phosphane 16%
• Coupled Cluster Methods 16%
• CCSD 16%
• Rhodium 16%
• dimer 16%
• electronics 16%
• olefin metathesis 16%