Code for paper "Accelerating the discovery of materials for integrated/complex device"
☆15Dec 20, 2023Updated 2 years ago
Alternatives and similar repositories for perovskite_htm_screening
Users that are interested in perovskite_htm_screening are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Neural network class for molecular dynamics to predict potential energy, forces and non-adiabatic couplings.☆11Nov 10, 2022Updated 3 years ago
- A software package for the high throughput construction, analysis, and featurization of two- and three-dimensional perovskite systems.☆31Sep 8, 2024Updated last year
- A Multi-Operator Equivariant Framework for High-Performance Machine Learning Force Fields, supporting External Fields embedding and Physi…☆17Updated this week
- This is a code and data repository to conduct Bayesian Optimization with knowledge constraints for manufacturing process of perovskite so…☆21Mar 30, 2022Updated 4 years ago
- Calculates 3d structure factor and simulated x-ray diffraction pattern from molecular dynamics trajectories☆18Nov 21, 2019Updated 6 years ago
- Managed hosting for WordPress and PHP on Cloudways • AdManaged hosting for WordPress, Magento, Laravel, or PHP apps, on multiple cloud providers. Deploy in minutes on Cloudways by DigitalOcean.
- Notebooks for 6.S088 IAP 2023☆16Aug 1, 2024Updated last year
- Tutorials of codes such as VASP, Quantum Espresso and Lammps☆14Apr 9, 2026Updated last week
- Python package for Moiré EXciton calculations☆14Aug 22, 2025Updated 7 months ago
- Calculation and visualization tools for theoretical solar cell efficiencies based on the Shockley Queisser limit with options to change t…☆56Feb 17, 2017Updated 9 years ago
- Python Rapid Artificial Intelligence Ab Initio Molecular Dynamics☆26Aug 26, 2022Updated 3 years ago
- ☆70Mar 20, 2026Updated 3 weeks ago
- ☆14Jan 9, 2025Updated last year
- ☆18Oct 23, 2024Updated last year
- Synology package for Omniedge☆18Feb 16, 2026Updated 2 months ago
- 1-Click AI Models by DigitalOcean Gradient • AdDeploy popular AI models on DigitalOcean Gradient GPU virtual machines with just a single click. Zero configuration with optimized deployments.
- ☆19Dec 1, 2025Updated 4 months ago
- Identification of the Dominant Recombination Process for Perovskite Solar Cells Based on Machine Learning☆16Oct 27, 2020Updated 5 years ago
- Handling Arbitrary Recognition of Data! y not?☆10Mar 25, 2023Updated 3 years ago
- ☆12May 10, 2024Updated last year
- ☆28Dec 16, 2024Updated last year
- Toolkit for visualizing phase stability and defects diagrams from DFT calculations of multicomponent materials.☆19Feb 20, 2024Updated 2 years ago
- Open-source first-principles computational toolkit for the efficient calculation of the strength of materials in 1D, 2D, and 3D materials…☆25Mar 29, 2025Updated last year
- Gold-Standard Chemical Database 138 (GSCDB138)☆33Mar 19, 2026Updated 3 weeks ago
- Benchmarking foundation Machine Learning Potentials with Lattice Thermal Conductivity from Anharmonic Phonons☆16Oct 30, 2024Updated last year
- GPUs on demand by Runpod - Special Offer Available • AdRun AI, ML, and HPC workloads on powerful cloud GPUs—without limits or wasted spend. Deploy GPUs in under a minute and pay by the second.
- Ferroelectric/Ferroelastic domain wall builder☆23Oct 17, 2024Updated last year
- Band alignment plotting tool☆26Mar 28, 2025Updated last year
- Model Context Protocol (MCP)☆17Mar 25, 2025Updated last year
- Free energy calculators by Bayesian-inspired nested sampling and other integration techniques☆23Mar 26, 2026Updated 3 weeks ago
- Drift-diffusion simulator for semiconductor devices☆29Apr 2, 2026Updated 2 weeks ago
- ☆19Apr 28, 2024Updated last year
- LED-Net: A lightweight and efficient dual-branch convolutional neural network designed to address the challenge of achieving high-perform…☆16Sep 9, 2025Updated 7 months ago
- CUDA implementations of MACE models☆23Aug 19, 2025Updated 7 months ago
- ☆27Jan 21, 2025Updated last year
- Managed hosting for WordPress and PHP on Cloudways • AdManaged hosting for WordPress, Magento, Laravel, or PHP apps, on multiple cloud providers. Deploy in minutes on Cloudways by DigitalOcean.
- Introdução à computação em física☆18Dec 5, 2023Updated 2 years ago
- Phonons from ML force fields☆23Mar 22, 2026Updated 3 weeks ago
- 光伏面板缺陷检测系统源码和数据集:改进yolo11-LAWDS☆25Nov 23, 2024Updated last year
- ☆30Dec 27, 2024Updated last year
- Flask biography application developed as one of http://pythonthusiast.pythonblogs.com article series☆20Sep 30, 2020Updated 5 years ago
- Julia implementation of various electron-correlation methods (main focus on coupled cluster methods).☆23Mar 12, 2026Updated last month
- 算法原理讲解及Python实现☆12Nov 2, 2021Updated 4 years ago