Fig. 4: Temporal variation of nuclear coordinates. | Communications Chemistry

Fig. 4: Temporal variation of nuclear coordinates.

From: Ultrafast probing of isotope-induced explicit symmetry breaking in ethylene

Fig. 4: Temporal variation of nuclear coordinates.The alternative text for this image may have been generated using AI.

a The temporal evolution of the dihedral angle, Φ, defined by H3C1C2H6 (solid lines) and H3C1C2H5 (dashed lines) in different isotopologues (12C2H4 in red, 13C2H4 in green, and 13C12CH4 in blue) upon excitation to the D3 electronic state. b The same as a but for the distance, d, between carbon atom C1 and hydrogen atom H5. c Once again the same as a but for the angle, α, identified by atoms H5C2C1. The inset in each case shows the corresponding definition for the coordinate. d The time dependent variation of the average normal mode (CH2 scissoring) displacements. In all the analyses the frames in which H-loss and H2 or, 2H-loss takes place are excluded.

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