Codes (serial and parallel with inputs, build structures, scripts) etc...
\Volumes\ziMac\codes\scripts  Van der Waals potentials for O, Si, C, H [iMacmzh]
 CNT 1 2 3
 Graphene
 SiO2 (quartz, amorphous), HfO2, CuO2 (magnetic)
 Si, Ge (MD OpenMP and mpi parallel)
 TB [sp3d5s*, sp3s*] (F90)
 EPM (Si and Ge parameters) (Matlab)
 DFT for an atom with any number of electrons (Matlab)
 Multiphase issues in QD (FEM and Matlab)  due full functionality
 Bandoffset
 Deformation potential
 Workfunction
 Phonon (separating phonon modes in binary alloys)
 Bands (high symmetry points)
 Electron dependent transport properties from DFT
 Lattice constant (Murnaghan EOS)
 Interface (SiO2Gr, SiO2CNT, AGNRSiO2, ZGNRSiO2)
 FCC lattice (with N number of atoms)
 Number of neighbors (with N number of atoms)
 Boltzmann transport equation for electron transport calculations (kparallel)
 GreenKubo
