Keyphrases
Indirect Spin-spin Coupling Constants
100%
Coupled Cluster
100%
Polarization Propagator
100%
Vibrational Corrections
100%
Small Hydrocarbons
100%
Zero Point
60%
Ethyne
40%
Approximation Results
20%
Density Functional Theory
20%
Ethene
20%
Coupling Constant
20%
Equilibrium Geometry
20%
Indirect nuclear Spin-spin Coupling Constants
20%
CFOUR
20%
B3LYP Functional
20%
B3LYP
20%
Allenes
20%
Cyclopropenes
20%
Aug-cc-pVTZ-J
20%
Carbon-carbon Bond Formation
20%
Chemistry
NMR Spectroscopy
100%
Coupled Cluster Singles and Doubles Theory
100%
Spin-Spin Coupling Constant
100%
Hydrogen
66%
DFT-B3LYP Calculation
66%
Allene
33%
Ethylene
33%
Nuclear Spin-Spin Coupling
33%
Density Functional Theory
33%
Cyclopropene
33%