merrygoat / bks-silicaView external linksLinks
Simulations of BKS silica in LAMMPS
☆13Nov 21, 2018Updated 7 years ago
Alternatives and similar repositories for bks-silica
Users that are interested in bks-silica are comparing it to the libraries listed below
Sorting:
- ☆11Jan 1, 2019Updated 7 years ago
- ☆21Feb 13, 2025Updated last year
- MoS2 FET Simulation using COMSOL Multiphysics☆32Jul 23, 2020Updated 5 years ago
- D3Q + thermal2☆26Nov 3, 2025Updated 3 months ago
- Statistical mechanics models such as random cluster models, random growth models and related processes.☆12Jan 24, 2025Updated last year
- How-to for working with COMSOL for Crystal Plasticity☆10Aug 10, 2020Updated 5 years ago
- Package to run atomic / molecular Monte Carlo simulations☆20Feb 10, 2026Updated last week
- Software to calculate atomic scattering factors and properties for Quantum Crystallography☆13Updated this week
- The Density Functional Theory for Electrolyte Solutions☆10Sep 13, 2022Updated 3 years ago
- This is the repository of code and data for paper "Machine learning-enabled chemical space exploration of all-inorganic perovskites for p…☆10Sep 23, 2024Updated last year
- The future of Packmol☆40Updated this week
- Material for the 3rd i-CoMSE Workshop: Methods for Advanced Sampling☆42May 1, 2023Updated 2 years ago
- Tutorial for the usage of the dcTMD approach and Langevin simulations employing the trypsin-benzamidine complex as example.☆11Jul 15, 2024Updated last year
- Discriminator for Model Docking☆11Dec 20, 2024Updated last year
- PFAScreen is an open-source Python based non-target screening software tool to prioritize potential PFAS features in raw data from LC- o…☆15Jan 28, 2026Updated 2 weeks ago
- A C++ implementation of the percolation problem☆11Apr 13, 2020Updated 5 years ago
- PAPRECA hybrid off-lattice kinetic Monte Carlo/molecular dynamics (kMC/MD) simulator☆15Aug 15, 2025Updated 6 months ago
- pyMBE provides tools to facilitate building up molecules with complex architectures in the Molecular Dynamics software ESPResSo. For an…☆12Nov 10, 2025Updated 3 months ago
- ☆13Dec 14, 2024Updated last year
- Pychastic is a stochastic differential equations integrator written entirely in python.☆12Feb 12, 2025Updated last year
- Estimating high-order interactions in time series data of any dimension☆17Sep 5, 2025Updated 5 months ago
- Python-based tool to calculate instantaneous interfaces and concentration/orientation profiles from molecular simulation trajectories in …☆12Nov 5, 2019Updated 6 years ago
- A Finite Element Approximation of a Cahn--Hilliard Tumour Model with FEniCS, by Dennis Trautwein (2020).☆10Oct 11, 2020Updated 5 years ago
- This repository contains the codes used for simulating the cases discussed in the manuscript: Impact forces of water drops on superhydrop…☆11Sep 19, 2023Updated 2 years ago
- ☆13Feb 27, 2023Updated 2 years ago
- ☆10Nov 19, 2025Updated 2 months ago
- This package will help you perform a multiple minumum Monte Carlo conformer search as described in Chang et al., 1989. It is built to be …☆32Jan 22, 2026Updated 3 weeks ago
- In this project, we give python and C++ codes for the Ring Polymer Molecular Dynamics (RMPD) to calculate the time correlation function(…☆12Dec 31, 2017Updated 8 years ago
- A library for converting molecular topologies☆13May 20, 2015Updated 10 years ago
- Phonon Boltzmann Transport Equation☆48May 15, 2025Updated 9 months ago
- Input files and results of paper: Phase equilibrium of liquid water and hexagonal from ice enhanced sampling molecular dynamics simulatio…☆10Apr 9, 2021Updated 4 years ago
- A Julia interface to a distributed task-based workflow management system☆16Jan 19, 2026Updated 3 weeks ago
- mirrored from https://gitlab.com/ccp5/dl-poly/☆10Jan 27, 2026Updated 3 weeks ago
- Awesome list about AI4Polymer☆17Sep 23, 2025Updated 4 months ago
- A dissipative particle dynamics (DPD) project.☆13Aug 16, 2023Updated 2 years ago
- Files associated with Hall group publications☆11Aug 1, 2025Updated 6 months ago
- Supplementary scripts for Z1+ users☆16Dec 12, 2025Updated 2 months ago
- Source code for "Nucleosome plasticity is a critical element of chromatin liquid –liquid phase separation and multivalent nucleosome inter…☆13Jun 17, 2022Updated 3 years ago
- Constant pH simulation with OpenMM☆18Mar 26, 2025Updated 10 months ago