KyuJungJun / CorrelationAnalyzerLinks
Analyze correlations in lithium-ion diffusion trajectories
☆11Updated last year
Alternatives and similar repositories for CorrelationAnalyzer
Users that are interested in CorrelationAnalyzer are comparing it to the libraries listed below
Sorting:
- ☆61Updated 4 months ago
- ☆43Updated 7 years ago
- ☆29Updated 3 years ago
- Examples demonstrating how to reproduce the results in the paper.☆58Updated 10 months ago
- ASE interface for fully constant potential with VASP☆35Updated 11 months ago
- Defect structure-searching employing chemically-guided bond distortions☆105Updated 3 weeks ago
- ☆48Updated 11 months ago
- Anharmonic Lattice Dynamics☆161Updated last week
- Python library for point-defect calculations in non-metallic solids based on first-principle calculations with the VASP code.☆62Updated 3 weeks ago
- XDATCAR_toolkit- A tool for convert XDATCAR to PDB☆62Updated 6 years ago
- A python interface of NEP☆61Updated 9 months ago
- cp2k postprocessing tools☆69Updated 3 months ago
- Calculate Spectrum Based on Fast Fourier Transform (FFT) of the Velocity Autocorrelation Function (VACF).☆26Updated 2 years ago
- Tutorials related to GPUMD☆44Updated 4 months ago
- A Toolkit for GPUMD&NEP☆43Updated last week
- NepTrainKit is a Python package for visualizing and manipulating training datasets for NEP.☆72Updated this week
- ☆27Updated last month
- Phonon anharmonicity analysis from molecular dynamics☆130Updated last week
- Defect analysis modules for pymatgen☆55Updated last week
- LAMMPS interface for phonon calculations using phonopy☆88Updated last year
- Compiled binaries and sources of LAMMPS, redistributed by AdvanceSoft Corp.☆57Updated 2 months ago
- ☆57Updated 3 years ago
- A grain boundary generation code☆74Updated 2 years ago
- A python class for parsing VASP XDATCAR from molecular dynamics☆25Updated last year
- Visualize vibrational modes from VASP calculations☆43Updated 7 months ago
- Dealing with slabs for first principles calculations of surfaces☆64Updated last year
- Python package to analyse the structural dynamics of perovskites☆44Updated 3 weeks ago
- A tool for streamlining data analysis and visualisation for thermoelectrics and charge carrier transport in computational materials scien…☆52Updated 4 months ago
- Catalyst Micro-kinetic Analysis Package for automated creation of micro-kinetic models used in catalyst screening☆13Updated 9 years ago
- CP2K Editor is a simple GUI for creating input files in the atomistic program CP2K. It is a easy and fast way to create the complex input…☆55Updated 6 years ago