Figure 3.
QM (solid lines) and Drude (dashed lines) calculated potential energy surfaces for rotating dihedral angle CD33A-CD2C1A-CD2C1A-CD32A (a), and CD2C1A-CD2C1A-CD32A-CD33C (b) in 2-pentene.
QM (solid lines) and Drude (dashed lines) calculated potential energy surfaces for rotating dihedral angle CD33A-CD2C1A-CD2C1A-CD32A (a), and CD2C1A-CD2C1A-CD32A-CD33C (b) in 2-pentene.