FEMME

  • Level of openness 0 ☆☆☆
  • Document quality 3 ★★★

An application for micromagnetic simulation optimized for industrial use of magnetic device design. This application can simulate read-out/write-in by a disk head in a hard disk device, magnetic recording media, and spatial profiles of magnetization in MRAM devices. This application also implements long-time simulation by a Monte Carlo method, treatment of thermal noise, and modeling of granular structures.

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ALPS

  • Level of openness 3 ★★★
  • Document quality 3 ★★★

ALPS is a numerical simulation library for strongly correlated systems such as magnetic materials or correlated electrons. It contains typicalsolvers for strongly correlated systems: Monte Carlo methods, exact diagonalization, the density matrix renormalization group, etc. It can be used to calculate heat capacities, susceptibilities, magnetization processes in interacting spin systems, the density of states in strongly correlated electrons, etc. A highly efficient scheduler for parallel computing is another improvement.

※Related links are temporary changed due to the server maintenance for ALPS project.

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CASTEP

  • Level of openness 0 ☆☆☆
  • Document quality 3 ★★★

Software for first-principles calculation based on pseudo-potential and plane-wave basis. This software performs electronic-state calculation of various systems by density functional theory, and can treat structure optimization, excited-state analysis, and so on. This software can be applied to many physical phenomena such as catalysis reaction, calculation of phase diagram, etc. There are many users of this payware in the world.

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GPAW

  • Level of openness 3 ★★★
  • Document quality 3 ★★★

An open-source application for first-principles calculation based on the PAW method. By utilizing real-space or atom-localized basis sets, this application performs electronic structure calculation based on the density functional theory as well as the GW approximation. Simulations are set up using the interface provided by Atomic Simulation Environment (ASE). The code is written in C and python, and is available under GPL.

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mumax3

  • Level of openness 3 ★★★
  • Document quality 3 ★★★

An open-source application for micromagnetic simulation optimized for general-purpose computing on GPU. This application can calculate spatial distribution of magnetization with speed of more than 100 times compared with CPU calculation. This application can also treat the RKKY interaction, effect of spin injection, and Voronoi diagrams. It supports remote computing using its web-GUI system.

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Vampire

  • Level of openness 3 ★★★
  • Document quality 3 ★★★

An open-source application for micromagnetic simulation from an atomic scale to an micro-meter scale. This application can perform dynamical simulation of spins and phase-space search based on a Monte Calro method. This application can also treat complex systems such as antiferromagnets and alloys. The code is written in object-oriented programing, and is optimized for efficient parallel computing.

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QUANTUM ESPRESSO

  • Level of openness 3 ★★★
  • Document quality 3 ★★★

Open-source program for first-principles calculation based on pseudo-potential and plane-wave basis. This package performs electronic-state calculation with high accuracy based on density functional theory. In addition to basic-set programs, many core-packages and plugins are included. This package can be utilized for academic research and industrial development, and also supports parallel computing.

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ecalj

  • Level of openness 3 ★★★
  • Document quality 2 ★★☆

An open-source program package for first-principles calculation based on a mixed augmented plane wave method (the PMT method). For various physical systems, this package performs electronic structure calculation and structure optimization by LDA, GGA, LDA+U and so on. It further can treat quasi-particle excitation with high accuracy by the quasi-particle self-consistent GW method. It implements several original methods not included in other program packages, and is maintained by the version control system, Git.

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Parsec

  • Level of openness 3 ★★★
  • Document quality 2 ★★☆

Parsec is a DFT program package based on real space basis and norm-conserving pseudopotential.

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ALPSCore/CT-HYB

  • Level of openness 3 ★★★
  • Document quality 2 ★★☆

An open-source impurity solver based on the quantum Monte Carlo method. Thermal equilibrium states of interacting impurity systems, such as the impurity Anderson model, can be evaluated by the continuous-time hybridization-expansion quantum Monte Carlo method. It can be used as a solver of effective impurity models derived from the dynamical mean-field theory (DMFT) and can deal with multi-orbital models. This package supports parallel computation by MPI and is developed based on the ALPSCore library.

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