Building AI Infrastructure for
Building open datasets, foundation models, and scientific AI infrastructure
to accelerate the discovery of next-generation materials for batteries,
semiconductors, energy storage, and beyond.
ABOUT US
Scandium Labs is an AI for Science research company building open infrastructure for computational materials discovery. We develop high-quality materials datasets, foundation models, and machine learning systems that help researchers explore millions of candidate materials before expensive laboratory or DFT validation. Our mission is to make materials discovery faster, reproducible, and accessible.
THE PROBLEM
Today's materials discovery is too slow. Each DFT calculation takes hours to days. Experimental validation takes weeks to months. Millions of candidate materials remain unexplored because the computational and experimental cost of screening them is prohibitive.
OUR APPROACH
Curate high-quality materials data from multiple sources. Train physics-aware foundation models. Screen millions of candidates in minutes. Prioritize only the most promising materials for expensive simulation and laboratory validation.
OPEN DATASET
A harmonized, quality-scored dataset combining Materials Project, OQMD, and JARVIS — designed for AI-driven materials discovery. 267,230 materials with standardized properties, cross-source provenance, and rigorous validation.
COVERAGE
Unique material entries from 3 major databases
PROPERTIES
Formation energy, band gap, energy above hull, density, volume, space group, crystal system, magnetic ordering, and more
LICENSE
Openly available for research and commercial use with attribution
WHAT WE BUILD
From open materials datasets to physics-aware foundation models, we build the infrastructure that enables researchers to accelerate materials discovery with AI.
A harmonized dataset combining Materials Project, OQMD, and JARVIS with quality scores, provenance tracking, and standardized material properties for AI-driven materials research.
Physics-aware graph neural networks trained on large-scale crystal datasets for transferable materials property prediction across diverse material families.
Accelerating screening of solid electrolytes, cathodes, and anodes through AI-guided discovery pipelines purpose-built for solid-state battery materials.
Open datasets, reproducible benchmarks, and developer tools that make AI-driven materials research accessible to the global scientific community.
SCANDIUM DATASET
OUR RESEARCH
Our research forms the scientific foundation of the Scandium Labs platform. Every dataset and model is built on rigorous validation, cross-source verification, and reproducible pipelines.
2025
ARCHITECTURE
A research line focused on improving generalization and physical consistency through constrained message passing for crystal property prediction.
2025
DATASET
A harmonized, quality-scored dataset of 267,230 materials from MP, OQMD, and JARVIS with provenance tracking and standardized properties for AI-driven discovery.
BENCHMARK
Standardized evaluation of AI models on solid-state battery electrolyte discovery, with reproducible splits, metrics, and baselines.
PUBLICATIONS & RELEASES
FOUNDER
Scandium Labs was founded with a simple belief: the next breakthrough in energy, computing, and sustainable technologies will begin with better materials. By combining machine learning, computational materials science, and open scientific infrastructure, we aim to accelerate how researchers discover and evaluate new materials.
"I started Scandium Labs because materials discovery shouldn't be limited by computational cost or fragmented data. Our goal is to build open AI infrastructure that helps researchers discover the next generation of materials faster."
RESEARCH
Physics-Informed Graph Neural Networks
OPEN DATA
Scandium Dataset · 267,000+ materials
AI MODELS
Foundation Models for Materials Science
APPLICATIONS
Solid-State Battery Discovery
COLLABORATE
Scandium Labs welcomes researchers, students, and industry partners who share our vision for accelerating materials discovery through AI.
EARLY ACCESS
Scandium Labs is providing limited early access to its Solid-State Battery Dataset and Foundation Models for researchers and industry partners working on computational materials science.
RESEARCH ACCESS
For academic researchers, universities, and open-source contributors.
INDUSTRY PREVIEW
For battery manufacturers, energy companies, and industrial R&D teams.
Currently in Early Research Preview. Access is granted based on research relevance, collaboration opportunities, and available capacity.
COMMUNITY
Our work is built in the open. Follow our progress across platforms and join the community.
700+
Dataset Downloads
2M+
Model Trained On
2.5K
LinkedIn Followers
3
Research Platforms
GET IN TOUCH
Whether you want to discuss a research collaboration, dataset feedback, industry partnership, academic collaboration, or open-source contribution — we'd love to hear from you.
OUR VISION
We believe the future of scientific discovery will be accelerated by open data, reproducible machine learning, and collaborative research. Scandium Labs is building the infrastructure that enables researchers worldwide to discover the next generation of materials faster than ever before.