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DFT: Stretching frequency of a diatomic molecule Cl2, phonon dispersion relations of diamond, and LO-TO splitting, IR activity, and dielectric constant of GaAs (Tutorial 4.1)

2018 PARADIM SUMMER SCHOOL Lab 3

From  James Overhiser 114 plays

DFT: Band structure, and visualizing Kohn-Sham wavefunctions of Si, and calculation of UV/Vis spectra of GaAs (Tutorial 5.1)

2018 PARADIM SUMMER SCHOOL Lab 5

From  James Overhiser 225 plays