hidecode221b / LG4XLinks
A graphical user interface of Python lmfit package was developed for standard X-ray photoemission spectroscopy (XPS) curve fitting analysis. The interface streamlines the fitting procedures for validating results and their consistency.
☆54Updated 3 months ago
Alternatives and similar repositories for LG4X
Users that are interested in LG4X are comparing it to the libraries listed below
Sorting:
- generator of simple atomistic models☆28Updated 7 years ago
- Thermodynamic Phase Diagram Generator☆55Updated 3 years ago
- Euphonic is a Python package for efficient simulation of phonon bandstructures, density of states and inelastic neutron scattering intens…☆38Updated 3 weeks ago
- A toolbox for quickly build inputs and analyze results of DFT codes☆43Updated 2 years ago
- Implementation for computing nonradiative recombination rates in semiconductors☆49Updated last week
- A grain boundary generation code☆76Updated 2 years ago
- A module for ASE for elastic constants calculation.☆46Updated 8 months ago
- pwtools is a Python package for pre- and postprocessing of atomistic calculations, mostly targeted to Quantum Espresso, CPMD, CP2K and LA…☆70Updated 4 months ago
- Ab-initio Interface Materials Simulation Project for Grain Boundaries (AIMSGB)☆64Updated last year
- LAMMPS plugins for thermal conductivity and density of states calculation☆48Updated 6 years ago
- A 1D drift-diffusion simulator for semiconductor devices (LEDs, solar cells, diodes, organics, perovskites)☆73Updated last month
- A graphical user interface of Python lmfit package was developed for standard X-ray photoemission spectroscopy (XPS) curve fitting analys…☆26Updated last month
- Blender extensions for illustrations of phonons☆66Updated 6 years ago
- Calculates various definitions of effective mass from the electronic bandstructure of a semiconductor.☆81Updated 4 months ago
- LAMMPS interface for phonon calculations using phonopy☆88Updated last year
- On-the-fly calculation of Transport Properties☆26Updated 2 years ago
- Site-Occupation Disorder☆44Updated 6 months ago
- A for finding optimized SQS structures tool written in C++☆51Updated this week
- ELATE: Elastic tensor analysis☆84Updated 2 weeks ago
- Tool to read a logfile produced by LAMMPS into a simple python data structure with a get()-function providing the log data.☆64Updated 6 months ago
- BURAI, a GUI system of Quantum ESPRESSO☆69Updated 4 years ago
- Python package to analyse electron density & electrostatic potential grids☆87Updated last year
- A collection of tools for simulating vibrational spectra, which interfaces with the Phonopy package.☆169Updated 2 months ago
- A code to estimate transport coefficients from the cepstral analysis of a (multi)variate current stationary time series -- [FKA "thermoce…☆43Updated last month
- Atomistic Manipulation Toolkit☆91Updated 2 months ago
- This code shows how to calculate an IR spectrum from a LAMMPS MD simulation.☆53Updated 7 years ago
- Band structure unfolding made easy!☆57Updated last month
- Python interface for VASP☆86Updated 2 weeks ago
- Genetic algorithm for structure and phase prediction interfaced to GULP, LAMMPS and VASP.☆57Updated 2 years ago
- LiquidDiffract is a GUI program to process experimental X-ray diffraction data of liquids/amorphous solids.☆20Updated 3 months ago