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  2. Crystal Multifunctional NEGF-DFT Nano Electron Transport Solver NanoDCAL+ (Hulinks Co., Ltd.)

Crystal Multifunctional NEGF-DFT Nano Electron Transport Solver NanoDCAL+
Hulinks Co., Ltd.

About This Product

NanoDCAL+ is the successor to NanoDCAL, a state-of-the-art general-purpose ab initio quantum transport package that combines nonequilibrium Green's function method (NEGF) and density functional theory (DFT) to predict nonequilibrium quantum transport in nanostructures, including current-voltage properties in nanoscale devices. NanoDCAL+ is built with a new fundamental design, adding new features and improved performance. NanoDCAL+ (NanoDFT Calculator Plus) is implemented using the linear combination of atomic orbitals (LCAO) approximation of NEGF-DFT. It is a versatile tool for ab initio modeling of non-equilibrium quantum transport, and is the successor to NanoDCAL, which has contributed to hundreds of scientific papers in fields as diverse as molecular electronics, nanotubes, topological insulators, batteries, magnetic tunnel junctions, and metal grain boundaries. By leveraging the new features of this product, we promise to improve the technical foundation of your R&D projects.

■Main features

・Implemented in Fortran and Python languages Modularization, improved interfaces with third-party tools, and improved parallelism, hardware portability, and performance ・Targets molecular and nanoscale electronics (realistic large-scale systems up to 10,000 atoms) ・Spintronics (collinear, non-collinear, spin-orbit coupling) ・Semiconductor nanoelectronics (current-voltage characteristics) ・Conductivity and current calculation ・Conductance NanoDCAL+ is fully integrated with our new RESCU+ code, which has new features such as band unfolding and lattice defect tools. Scattering state, photocurrent, thermocurrent, and phonon calculations are available in its predecessor, NanoDCAL.

  • Product

    Crystal Multifunctional NEGF-DFT Nano Electron Transport Solver NanoDCAL+

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1 Models of Crystal Multifunctional NEGF-DFT Nano Electron Transport Solver NanoDCAL+

Image Part Number Price (excluding tax) Operating environment HDD Operating environment RAM Operating environment Processor Operating environment Compatible OS

NanoDCAL+

Available upon quote

Minimum: 5-8 GB for typical installation
Recommended: SSD

Minimum: 8 GB
Recommended: 16 GB or more

Minimum: Intel/AMD x86-64 processor
Recommended: Intel / AMD x86-64 processor supporting 4Core / AVX2 instruction set

Ubuntu 18.04/20.04
Red Hat Enterprise Linux 7/8

About Company Handling This Product

Hulinks Co., Ltd.

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