Tools & Techniques

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  • Material/Device Modeling Tools
    • DFT and NEGF Tools
      • Quantum ESPRESSO (opEn-Source Package for Research in Electronic Structure, Simulation, and Optimization)
      • VASP (Veinna Ab-initio Simulation Package)
      • SIESTA (Spanish Initiative for Electronic Simulations with Thousands of Atoms)
      • WEIN-2K
      • ABINIT
      • CASTEP (Cambridge Serial Total Energy Package)
      • ATK-VNL (Atomistix Tool Kit-Virtual Nano Lab)
    • Molecular Dynamics Tools
      • GROMACS (GROningen MAchine for Chemical Simulations)
  • Device/Circuit Modeling tools
    • SIMON (For modeeling Single Electron Transistor based circuits)
    • Cadence (using in coordination with VLSI lab)
    • P-Spice (using in coordination with VLSI lab)
    • Silvaco (using in coordination with VLSI lab)
  • Computational Resources
    • 4 user accounts on Param YUVA Supercomputer at NPSF CDAC. (each account allows 8 parallel job submissions)
    • 3 High performace Servers
    • 30+ latest configured Desktops