Data for: Vibrational Dynamics of 4-fluorobenzaldehyde from periodic DFT calculations
Published: 31 March 2020| Version 1 | DOI: 10.17632/xc25vck3zc.1
Contributor:
Paulo Ribeiro-ClaroDescription
Inelastic Neutron Scattering Spectrum of pure 4-Fluorobenzaldehyde (TOSCA instrument/ISIS) Mid and Far-IR spectrum of pure 4-Fluorobenzaldehyde CASTEP optimized structure of 4-Fluorobenzaldehyde crystal
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Physical Chemistry, Computational Spectroscopy, Computational Chemistry, Vibrational Spectra