bruceravel / demeter
Process and analyze X-ray Absorption Spectroscopy data using Feff and either Larch or Ifeffit.
☆68Updated last year
Alternatives and similar repositories for demeter:
Users that are interested in demeter are comparing it to the libraries listed below
- Core-Level Spectroscopy Simulations in Python☆41Updated 2 months ago
- Larch: Applications and Python Library for Data Analysis of X-ray Absorption Spectroscopy (XAS, XANES, XAFS, EXAFS), X-ray Fluorescence (…☆146Updated this week
- Python based GUI-Program for integration and exploration of 2D x-ray diffraction images.☆60Updated this week
- Reads crystallographic cif files and simulates diffraction☆59Updated last month
- A graphical user interface of Python lmfit package was developed for standard X-ray photoemission spectroscopy (XPS) curve fitting analys…☆51Updated last year
- EXAFS AI☆16Updated last year
- Blender extensions for illustrations of phonons☆63Updated 6 years ago
- Suite of programs to simulate disordered and nanomaterials☆58Updated this week
- Visualise lattice vibrations☆92Updated last month
- X-ray Reference Data in SQLite library, including Python interface☆56Updated 2 months ago
- Command-line utilities and Python libraries designed to make life with VASP easier☆54Updated 5 years ago
- Implementation for computing nonradiative recombination rates in semiconductors☆46Updated 5 months ago
- Debye's scattering equation & other analysis of atomistic models.☆52Updated last year
- Phonon anharmonicity analysis from molecular dynamics☆122Updated 4 months ago
- xrayutilities - a package with useful scripts for X-ray diffraction physicists☆89Updated 2 months ago
- A python program for calculating the mass of XAFS [X-Ray Absorption Fine Structure] samples. The chemical formula parser understands pare…☆9Updated 2 months ago
- LiquidDiffract is a GUI program to process experimental X-ray diffraction data of liquids/amorphous solids.☆19Updated 10 months ago
- A collection of tools for simulating vibrational spectra, which interfaces with the Phonopy package.☆155Updated 2 weeks ago
- generator of simple atomistic models☆27Updated 6 years ago
- Calculates various definitions of effective mass from the electronic bandstructure of a semiconductor.☆78Updated last year
- Open-source library for analyzing the results produced by ABINIT☆120Updated last week
- A graphical user interface of Python lmfit package was developed for standard X-ray photoemission spectroscopy (XPS) curve fitting analys…☆21Updated this week
- Web-enabled database of X-ray Absorption Spectra☆16Updated 5 months ago
- Course materials for NANO 106 - Crystallography of Materials☆34Updated 2 years ago
- Effective Mass Calculator for Semiconductors☆106Updated 4 years ago
- BURAI, a GUI system of Quantum ESPRESSO☆63Updated 3 years ago
- pwtools is a Python package for pre- and postprocessing of atomistic calculations, mostly targeted to Quantum Espresso, CPMD, CP2K and LA…☆66Updated 8 months ago
- Ab-initio Interface Materials Simulation Project for Grain Boundaries (AIMSGB)☆61Updated last year
- The python implementation of the Stochastic Self-Consistent Harmonic Approximation (SSCHA).☆59Updated 4 months ago
- X-ray diffraction data analysis for high pressure and high temperature experiments☆17Updated 3 weeks ago