ovito 开源项目推荐（52 个）

pierrehirel /atomsk

Atomsk: A Tool For Manipulating And Converting Atomic Data Files -

killiansheriff /WarrenCowleyParameters

OVITO Python modifier to compute the Warren-Cowley parameters.

killiansheriff /AtomisticReverseMonteCarlo

OVITO Python modifier to generate bulk crystal structures with target Warren-Cowley parameters.

phynite-lab /phynite-lab

Open-source local computational materials-science workspace: Quantum ESPRESSO, LAMMPS, analysis and figures. GNU AGPL v3.

N720720 /lindemann

lindemann is a python package to calculate the Lindemann index of a lammps trajectory

stefanbringuier /HowToSOVITO

A series of recipes and tutorials on how to use python scripting with OVITO

rodyherrera /Trybo

Nanotribology Simulation Framework. Create modern workflows to automate the study of friction wear with Lammps and OVITO 🚀

ovito-org /ScoreBasedDenoising

This is a wrapper for OVITO around the "Score-based denoising for atomic structure identification" presented in this graphite repo. Further information and the official citation on arXiv.

ovito-org /RingFinder

OVITO Python modifier to find shortest rings formed by bonds in a system

Aaron-Cuevas /ovito-blender-visualizer

OVITO → Blender Visualizer: scripts to play OVITO/LAMMPS dumps in Blender (viewport realtime), PC2 bake + Geometry Nodes instancing, scalable particle shapes, stable renders.

MdAnowarulShafinKhan /hcp-ti-soap-plasticity-md

Molecular dynamics, PTM, and SOAP analysis of the elastic-to-plastic transition in HCP titanium under uniaxial compression.

ckalcher /CalculateVoronoiStatistics

This OVITO Python modifier generates a histogram of the Voronoi motifs sorted by occurence.

ovito-org /GenerateRandomSolution

OVITO Python modifier to chang the particle type values to create a random solid solution of a given composition.

niaggar /GaltonBoard

Windows application to simulate the Galton board, allows you to configure different parameters of the problem.

tatvakabat /A-Molecular-Dynamics-Study-of-Energy-Minimization-in-Mono--and-Bilayer-Graphene-Structures

Code, graphs, and input files utilized within graphene energy minimization research being conducted in an internship under NJIT's Prof. Dibakar Datta

ovito-org /PythonModifierTemplate

Template for a custom Python modifier which hooks into OVITO

ovito-org /MatchMolecule

Match parts of molecules using query strings

ovito-org /SurfaceMeshIO

A file reader & writer for OVITO surface meshes with their auxilliary information

ovito-org /ReduceProperty

Apply reduction operations to OVITO properties

wjgoarxiv /ChillPlus_sorter

::Efficient toolkit for processing and analyzing CHILL+ data from OVITO visualization software::