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Storion Lab knowledgebase

Our Resources

Internal Lab Resources

Internal Skoltech Resources

  1. Pardus

Getting started

Software

Our Developed software

  • SIMAN (Wiki) (a set of Python tools for high-througput DFT calculations and their analysis)
  • GB (C++ tool for construction of grain boundaries in metals)
  • Diffraction (C++ and Fortran tool for constructing theorectical electronogramms of crystal structures)
  • BVlain. Python tool for making bond valence analysis in crystal structures and determine percolation barriers of ionic conduction
  • Ions. Python library made for studying percolation in ionic crystals

Other Materials modeling software including cloud

  • Atomsk - a set of tools for structure manipulation useful in DFT calculations
  • UniMoVib A unified interface for molecular harmonic vibrational frequency calculations. (Vibrational analysis, partial hessian)
  • Packmol allows to fill box by molecules

Materials Cloud tools

Simulation

Visualization

Theory

Mini review

Linux

General

Workload managers

Python

Github

Tutorials

Useful services

Databases

Communities

Calculators

Working with image

Glossary

Telegram

  • Sci Journal Club - Community in Telegram for sharing sci papers (write DOI - someone who has access send you a pdf)

Library

English Communication for Scientists

Modeling groups in the world

SSE groups in Russia

Evgenia Ilyna

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