Materials Square is
All-in-one materials simulation web platform.|

We provides Quantum Espresso for DFT and LAMMPS for MD simulation which are open sources. The interface is designed exclusively for MatSQ users and offers templates that are easy to use even for beginners of the simulation.

Easy-to-use User Interface

Robust Analysis Tools

Free Structure Modeling

Cloud High Performance Computing

Pay only for
cloud server usage for calculations.

Materials Square is based on the optimized cloud HPC environment. Stop worrying about server installation and maintenance.

Pay-As-You-Go pricing policy

You pay only when you perform computation.
It's about 1.3USD/10min for each server(36cores)

Low Cost based only on Computation

No more financial overhead to buy your own HPC servers and software.

Sign up for free and get $10!

Enjoy many useful functions for free, such as the modeling complex structures and post-processing of the computation results.

How to get data with MatSQ

> More Samples
1. Convergence Test: Cutoff Energy
2019-07-24 13:11:40

Convergence test is a way of optimizing a simulation to use limited computational resources efficiently. It is important to find a proper initial input setting for simulation research to decide the accuracy and reliability of the simulation.

2. Convergence Test: K-points
2019-07-24 13:16:02

In the first email that we sent last week, we briefly introduced convergence tests and how to conduct one by using the total energy. This time, we would like to explain how to perform the test by using the number of k-points.

3. How to Calculate Cohesive Energy
2019-07-24 13:20:38

The energy for bonding can be calculated using the difference between a bonded structure and a dissociated one. This energy, which is necessary to separate an atom from the solid, is called cohesive energy.

We’re Here to Help.

We provide both user training(free of charge) and expert consult service from research plan to data interpretation.