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Acetylene
Couplings
1
DFT/B3LYP
1
Equilibrium geometries
1
Ethane
1
Ethylene
1
Fourier series
1
Geometry
1
Karplus equation
1
Lighting
1
Nuclear coordinates
1
Proton-proton coupling constants
1
Protons
1
Torsional stress
1
Truncated Fourier series
1
Vibrational contributions
1
Vicinal coupling constants
1
extended Karplus equations
1
intramolecular surfaces
1
vibrational contributions
1
vicinal coupling constants
1
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1