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Intramolecular and Low-Frequency Intermolecular Vibrations of Pentacene Polymorphs as a Function of Temperature
Single crystals of pentacene with different morphologies (polymorphs C and H) have been studied by Raman
spectroscopy as a function of temperature from 79 to 300 K. All Raman active lattice modes and a range of
low-frequency intramolecular modes have been identified and assigned. The experiments are compared with
quasi harmonic lattice dynamics (QHLD) calculations of the crystallographic structures and vibrational
frequencies as a function of temperature. Experiments and calculations both indicate that the two polymorphs
are stable over a wide temperature range
Lattice dynamics and electron-phonon coupling in beta-(BEDT-TTF)<SUB>2</SUB>I<SUB>3</SUB>
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