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Quantum Simulations on Dynamical Heterogeneous Catalysts

J. I. ENRIQUEZ, H. H. HALIM, S. E. M. PUTRA, T. N. PHAM, Y. J. WONG, Y. HAMAMOTO, K. INAGAKI, I. HAMADA, and Y. MORIKAWA

ISSP Activity Report 2020, p. 61-62…Read More

Search and realization of novel electronic properties of solid surfaces and interfaces and of small particles

Takeshi INAOKA

ISSP Activity Report 2020, p. 163-164…Read More

Development of analysis method for molecular crystal surface using wave number space-resolved photoelectron spectroscopy

Kaori Niki

ISSP Activity Report 2020, p. 180-181…Read More

First-principles study of atomic and electronic structures of intermetallic compound catalysts

Kazuki NOZAWA

ISSP Activity Report 2020, p. 151…Read More

Voice from the FPSEID21developer

Features of FPSEID21 This application uses the Suzuki-Trotter decomposition scheme to warrant numerical stabil…Read More

Tutorials

https://damask.mpie.de/documentation/video_tutorials.html https://damask.mpie.de/documentation/examples/index.…Read More

Voice from the developer of DAMASK

History of DAMASK DAMASK started as a user material subroutine for crystal plasticity to be used in  commercia…Read More

Simulation of Micellar Self-Formation using LAMMPS

MateriApps Developer Team

1. Introduction The molecular dynamics software LAMMPS can be used to handle soft matter problems. In particul…Read More

How to use OpenMX on ohtaka (ISSP supercomputer)

Masahiro FUKUDA

Abstract OpenMX is a free software for first-principles electronic structure calculations. It is preinstalled …Read More

How to install Quantum ESPRESSO on macOS using MateriApps Installer

MateriApps Development Team

1. Introduction This review explains how to install Quantum ESPRESSO on macOS (Sonoma) using Homebrew and the …Read More

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