ABINIT-MP(Open Ver.1 Rev.22)

ABINIT-MP is an application software which can perform efficient quantum chemical calculations of large molecules such as proteins based on the fragment molecular orbital (FMO) method. It includes graphical user interface system (named BioStation Viewer) to assist both preparation of input-data and analysis of ourput-data. The second-order perturbation calculation under a four-body fragment expansion (FMO4-MP2) is available as well.
How to use Official website
 

FrontFlow/blue(8.1)

FrontFlow/blue (FFB) is a general-purpose flow solver, which is based on Large eddy simulation (LES) and capable of accurately predicting incompressible unsteady fluid-flows. FFB adopts the Finite Element Method (FEM) for the spatial discretization method, and can be applied to the prediction of flows in a complicated geometries and resulting sound such as those in a pump and a fan.
How to use Official website
 

FrontISTR(5.1.1)

FrontISTR is an open-source large-scale parallel finite element method (FEM) program for nonlinear structural analysis. Running on a note PC, PC clusters and supercomputers, FrontISTR provides innovative tools for practical and advanced structural analysis.
How to use Official website
 

GENESIS(1.5.1)

GENESIS (Generalized-Ensemble Simulation System) is a suite of computer programs for carrying out large-scale parallel molecular dynamics (MD) simulations of biomolecular systems. Highly efficient parallelization algorithms are utilized enabling to simulate biomolecule dynamics for a wide range of size scales, from the single molecule level to huge systems consisting of hundreds of millions of atoms, such as in cellular environments. Moreover, simulation time scale can be extended using enhanced sampling algorithms.
How to use Official website
 

HΦ (3.4.0)

HΦ is an open source software package analyzing the quantum many-body lattice models based on the numerical exact diagonalization method. The software is capable of computing the ground state, low-excitation state, excitation spectra and thermodynamic quantities at the finite temperature of the various many-body quantum systems, such as multi-orbital Hubbard model,Heisenberg model, and Kondo lattice model.
How to use Official website
 

MODYLAS (1.1.0)

MODYLAS is an Open Source Software (license permission required) package for general-purpose classical molecular dynamics. The software supports various methods required for the molecular dynamics computation in nano-molecules and biomolecules including the Fast Multiple Method (FMM) of treating long-range electrostatic interactions.
How to use Official website
 

NTChem (2013-11.1)

NTChem is an application software package for the molecular electronic structure calculation based on the Gaussian-type basis functions. Various kinds of functionalities for quantum chemistry approaches are available to users. It is designed for high-performance quantum chemistry calculations on massively parallel computers.
How to use Official website
 

OpenMX (3.9.2)

OpenMX is an Open Source Software package for the first-principles calculations. Using atom-localized basis functions and pseudopotential method, the software performs the electronic state computations for a wide range of physics systems such as crystals, interfaces, solutions.
How to use Official website
 

PHASE/0(2019.02)

PHASE/0 is a first-principles electronic structure calculation program of the plane wave basis by the pseudopotential scheme based on the density functional theory (DFT). It can calculate total energy, charge density, density of states, band structures, and stable atomic structure.
How to use Official website
 

SALMON (2.0.0)

SALMOM is an Open Source Software package based on first-principles calculations targeting researches related to interaction between light and materials. The software can be used for photo-excited electron dynamics and light propagation simulations based on time-dependent density functional theory using real-time and real-space grid method.
How to use Official website
 

SMASH (2.2.0)

SMASH is an Open Source Software package for massively parallel quantum chemical calculations. The software is capable of energy and geometry optimization calculations of the Hartree-Fock method, the DFT method and the MP2 method for nano-sized molecules without splitting or fragmenting.
How to use Official website