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A molecular vibration is a periodic motion of the atoms of a molecule relative to each other, such that the center of mass of the molecule remains unchanged. The typical vibrational frequencies range from less than 10 13 Hz to approximately 10 14 Hz, corresponding to wavenumbers of approximately 300 to 3000 cm −1 and wavelengths of approximately 30 to 3 μm.
A vibration will be active in the IR if there is a change in the dipole moment of the molecule and if it has the same symmetry as one of the x, y, z coordinates. To determine which modes are IR active, the irreducible representation corresponding to x, y, and z are checked with the reducible representation of Γ vib. [4]
Jablonski diagram including vibrational levels for absorbance, non-radiative decay, and fluorescence.. When a molecule absorbs a photon, the photon energy is converted and increases the molecule's internal energy level.
Researchers employ various organic and biochemical methods to introduce small vibrational probes into molecular systems into a variety of chemicals, proteins, nucleic acids, etc. [4] These probes, labeled with infrared (IR) markers, were subject to spectroscopic investigations to obtain quantitative insights into various features of chemical ...
Vibronic spectroscopy is a branch of molecular spectroscopy concerned with vibronic transitions: the simultaneous changes in electronic and vibrational energy levels of a molecule due to the absorption or emission of a photon of the appropriate energy.
Vibration (from Latin vibrāre 'to shake') is a mechanical phenomenon whereby oscillations occur about an equilibrium point.Vibration may be deterministic if the oscillations can be characterised precisely (e.g. the periodic motion of a pendulum), or random if the oscillations can only be analysed statistically (e.g. the movement of a tire on a gravel road).
In vibrational spectroscopy, an overtone band is the spectral band that occurs in a vibrational spectrum of a molecule when the molecule makes a transition from the ground state (v=0) to the second excited state (v=2), where v is the vibrational quantum number (a non-negative integer) obtained from solving the Schrödinger equation for the molecule.
Vibronic coupling (also called nonadiabatic coupling or derivative coupling) in a molecule involves the interaction between electronic and nuclear vibrational motion. [1] [2] The term "vibronic" originates from the combination of the terms "vibrational" and "electronic", denoting the idea that in a molecule, vibrational and electronic interactions are interrelated and influence each other.