Predict the band gap energy for inorganic materials
☆20Apr 21, 2024Updated 2 years ago
Alternatives and similar repositories for BandGapPredictor
Users that are interested in BandGapPredictor are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Predicting new perovskites with ensemble Machine Learning algorithms☆16Nov 8, 2025Updated 8 months ago
- Tutorial for performing machine learning to predict band gaps from the K computer double perovskite dataset☆21Jun 7, 2019Updated 7 years ago
- Software for analysis of time-resolved and transient absorption data from pump-probe experiments (1D) and 2D-IR☆16Jul 10, 2026Updated 2 weeks ago
- Comparative Analysis of Machine Learning Approaches on the Prediction of the Electronic Properties of Perovskite: A Case Study of the ABX…☆29Jan 11, 2022Updated 4 years ago
- code package with elemental property dictionary that trains a model based on training dataset and gives prediction on new perovskite comp…☆30May 15, 2018Updated 8 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.
- Introducing AlloyBERT: a transformer encoder-based model for predicting alloy properties from textual inputs. Leveraging RoBERTa and self…☆13Aug 5, 2024Updated last year
- Using the CGCNN transfer learning model to pridict the voltages of many kinds of metal-ion battery electrodes☆11Aug 23, 2022Updated 3 years ago
- A library to align rigid molecules and clusters☆13Jul 10, 2026Updated 2 weeks ago
- Band gaps of are intrinsic physical properties of periodic structures, for example, mechanical metamaterials or phononic crystals, which …☆22Sep 23, 2021Updated 4 years ago
- PaDEL ws descriptors engine☆14Jul 3, 2018Updated 8 years ago
- Perform and visualise object detection with OpenCV's CascadeClassifier☆12Oct 8, 2015Updated 10 years ago
- ☆17Oct 21, 2021Updated 4 years ago
- Supervised Regression using SVR and Neural Networks for Early Prediction of End-of-Life in Lithium-ion Batteries☆12Dec 24, 2023Updated 2 years ago
- ☆15May 17, 2024Updated 2 years ago
- Managed Database hosting by DigitalOcean • AdPostgreSQL, MySQL, MongoDB, Kafka, Valkey, and OpenSearch available. Automatically scale up storage and focus on building your apps.
- Codes to generate a bandgap database using ChemDataExtractor.☆10Jun 4, 2025Updated last year
- for Quantum Crystallography☆28Updated this week
- A python implementation of pdb2oniom for QM/MM (ONIOM) calculations☆12Oct 2, 2025Updated 9 months ago
- Identification of the Dominant Recombination Process for Perovskite Solar Cells Based on Machine Learning☆16Oct 27, 2020Updated 5 years ago
- Repository for the EMNLP 2023 Demo Paper "Reaction Miner: An Integrated System for Chemical Reaction Extraction from Textual Data"☆19Jan 27, 2025Updated last year
- Quantum-Wise VNL Application for Perovskite Building and Machine Learning☆12May 14, 2020Updated 6 years ago
- Accelerating Defect Prediction in Semiconductors Using Graph Neural Networks☆16Dec 9, 2024Updated last year
- "Lithium-Ion Battery Life Prediction Based on Initial Stage-Cycles Using Machine Learning"--PCA Model☆11Jan 19, 2020Updated 6 years ago
- c层调用ffmpeg在android上实现进行音频视频录制编码成h264/acc,输出mp4☆15Mar 9, 2018Updated 8 years ago
- Open source password manager - Proton Pass • AdSecurely store, share, and autofill your credentials with Proton Pass, the end-to-end encrypted password manager trusted by millions.
- Real-time prediction of Battery SoC in UAVs: A Machine Learning Perspective☆17Sep 27, 2025Updated 10 months ago
- Neural Network Crystal Synthesizability Predictor (NNCSP)☆12Aug 29, 2024Updated last year
- ☆17Jan 2, 2021Updated 5 years ago
- Spherical harmonic shape descriptors, promolecule densities, isosurfaces and Hirshfeld surfaces in python☆28May 8, 2026Updated 2 months ago
- sTDA-xTB Hamiltonian for ground state☆24May 19, 2022Updated 4 years ago
- SIMPLE-NN(SNU Interatomic Machine-learning PotentiaL packagE – version Neural Network)☆48Jan 27, 2022Updated 4 years ago
- Machine learning based RUL prediction of lithium ion battery☆14Mar 11, 2023Updated 3 years ago
- Codata constants for Fortran, C and Python.☆10Jul 18, 2026Updated last week
- Materials for the "Introduction to Computational Chemistry Techniques" course at the University of Edinburgh☆15Jan 20, 2026Updated 6 months ago
- Deploy on Railway without the complexity - Free Credits Offer • AdConnect your repo and Railway handles the rest with instant previews. Quickly provision container image services, databases, and storage volumes.
- Scripts to extract various properties from VASP OUTCAR file☆12Jul 30, 2023Updated 2 years ago
- Create, use, and analyze machine learning potentials within the many-body expansion framework.☆10Sep 4, 2025Updated 10 months ago
- Fortran pre-processor☆19Jan 27, 2026Updated 6 months ago
- ☆14Apr 30, 2025Updated last year
- Logistic Regression, ANN, CNN and RNN implemented using Pytorch☆15Jan 31, 2020Updated 6 years ago
- A Sequence Generation Model for Reaction Diagram Parsing☆28Jun 30, 2025Updated last year
- A data processing and machine learning project for prediction of the bandgap of HOIPs.☆12Jan 6, 2020Updated 6 years ago