A pre- and post-processing toolkit for atomistic simulations.
Project description
VIsual Periodic STructure EditoR
Master:
Testing:
Visualization and editing framework for atomistic simulations.
For more information, please visit the Homepage.
Binary releases are available here, installation instructions can be found here.
Most importantly, try it in your browser!
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| C++17 based backbone: Powerful container-classes and I/O | ||
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| Fast and native GUI with OGL3.3 based rendering | Portable browser-based GUI, shared render-code | Scripting interface for batch-processing |
Dependencies:
- JSON for Modern C++ >= 3.0 (included)
- CLI11 (included)
- tinyexpr (included)
- CMake >= 3.9
- and a C++17-capable compiler (g++/mingw > 7 or clang > 4)
- optional:
- Qt5 >= 5.7 (desktop application)
- emscripten (web interface)
- pybind11 (script interface, included)
- Catch2 (testing, included)
Supported file types:
| Format | Reading | Writing |
|---|---|---|
| xyz (augmented) | ✔ | ✔ |
| PWScf input | ✔ | ✔ |
| PWScf output | ✔ | |
| LAMMPS data | ✔ | ✔ |
| LAMMPS dump | ✔ | |
| CPMD input | ✔ | ✔ |
| Gaussian cube | ✔ | |
| XCrysden | ✔ | |
| ORCA input | ✔ | ✔ |
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