SHDShim / PeakPo
X-ray diffraction data analysis for high pressure and high temperature experiments
☆17Updated 2 years ago
Related projects ⓘ
Alternatives and complementary repositories for PeakPo
- Reads crystallographic cif files and simulates diffraction☆58Updated this week
- Python based GUI-Program for integration and exploration of 2D x-ray diffraction images.☆57Updated 4 months ago
- generator of simple atomistic models☆24Updated 6 years ago
- Docs and examples for Quantum-Espresso☆14Updated 7 years ago
- LiquidDiffract is a GUI program to process experimental X-ray diffraction data of liquids/amorphous solids.☆18Updated 5 months ago
- A graphical user interface of Python lmfit package was developed for standard X-ray photoemission spectroscopy (XPS) curve fitting analys…☆48Updated 9 months ago
- Crystal structure container and parsers for structure formats.☆34Updated last week
- DiffPy-CMI tutorial files for the ADD2019 workshop, ILL, Grenoble☆11Updated 5 years ago
- Jupyter notebooks for the Computing and Comunication skills 1st Year Materials Science Course at Manchester☆45Updated last year
- Suite of programs to simulate disordered and nanomaterials☆55Updated this week
- Core-Level Spectroscopy Simulations in Python☆40Updated last month
- Process and analyze X-ray Absorption Spectroscopy data using Feff and either Larch or Ifeffit.☆67Updated last year
- STEM/TEM/Coherent CBED image simulations☆50Updated 7 years ago
- A module for ASE for elastic constants calculation.☆35Updated 3 months ago
- Gaussian and Lorentzian smearing of simulated spectra☆35Updated last month
- PyXRD is a python implementation of the matrix algorithm for computer modeling of X-ray diffraction (XRD) patterns of disordered lamellar…☆51Updated 4 years ago
- Simulation package for constructing model band structures and calculate momentum resolved EEELS (low loss region) on the basis of these☆11Updated 3 years ago
- A command line tool written in Python/C++ for finding optimized SQS structures☆41Updated this week
- Extracts full elastic tensor from VASP OUTCAR and calculates some useful quantities☆25Updated 9 years ago
- A collection of scripts to interpret/organize VASP output files☆23Updated 8 years ago
- A grain boundary generation code☆56Updated last year
- Euphonic is a Python package for efficient simulation of phonon bandstructures, density of states and inelastic neutron scattering intens…☆29Updated this week
- Debye's scattering equation & other analysis of atomistic models.☆50Updated 11 months ago
- Toolkit using the Atomistic Simulation Environment (ASE)☆19Updated 4 years ago
- X-ray diffraction calculations☆7Updated 2 years ago
- Atomistic Manipulation Toolkit☆80Updated 6 months ago
- EXAFS AI☆16Updated last year
- Generating geometries for electronic structure calculations from CIF files.☆41Updated 2 weeks ago
- A Python suite for manipulating VASP input and output☆44Updated 5 months ago
- xrayutilities - a package with useful scripts for X-ray diffraction physicists☆83Updated 2 months ago