Master index | Index for Objects/iData_subclasses/@iData_vDOS |
iData_vDOS | |
incoherent | iData_vDOS: incoherent: compute the incoherent gaussian approximation scattering law S(q,w) from an initial density of states vDOS |
multi_phonons | iData_vDOS: multi_phonons: compute the integrated multi-phonon generalised density of states (gDOS) from an initial vibrational density of states (vDOS) |
thermochemistry | iData_vDOS/thermochemistry: compute thermodynamic quantities for 1D vDOS data sets. |