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Maurer group documentation
Experimental Techniques in Surface Science
Group Nodes
Group Responsibilities
HPC infrastructure
Induction for new group members
Lab Handbook
Presentation Skills
Recommended reading
Useful software & group licenses
Coding
Coding
Complex workflows
Complex workflows
- Ml gas surface dynamics
Electronic structure
Electronic structure
- Embedding Integral Generator
- ASE ASE
  Table of contents
  - Atomic Simulation Environment (ASE)
    
    Guide on how to use internet sockets with ASE
- ASI
- CASTEP XPS and NEXAFS Tutorial
- CASTEP
- Castep deltascf molpdos
- FHI-aims ΔSCF Tutorial
- FHI-aims
- GPAW
- ORCA
- TURBOMOLE
Julia
Julia
Machinelearning
Machinelearning
Visualisation
Visualisation

Table of contents

Atomic Simulation Environment (ASE)
- Guide on how to use internet sockets with ASE

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December 12, 2023 September 19, 2023

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