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Advancing Scientific Discovery
with AI

FirstPrinciples is building AI systems for discovery in fundamental science.

Theo

The Theo Platform is a research environment built to help researchers iterate faster, validate rigorously, and reach verified results they can trust

Mission

Breakthroughs in our understanding of nature have long driven progress across society. Our mission is to understand the nature of reality by advancing AI-driven discovery in fundamental science.

Bottleneck

For as long as humans have existed, we’ve always tried to understand the world around us. What we’ve learned so far is remarkable, but with progress comes increased complexity.
The growing burden of knowledge is slowing scientific progress, because human cognition can’t scale with the proliferation of information available.

Shift

The scientific method is also evolving. AI is moving from a tool to a research partner, creating a fundamental shift in how (and where) science is performed.
Academic systems are built on human-led discovery, whereas frontier AI is concentrated primarily within labs with commercial priorities. For AI to meaningfully participate in the scientific process, how it’s built (and who it’s for) matters deeply.

Stewardship

As AI becomes foundational to discovery, it must protect knowledge as a shared asset, not a proprietary advantage.
FirstPrinciples is building AI solely for fundamental research, transparent by design, and committed to knowledge as a public good.

Theo: Domain-Specialized AI for Science

A modular system built to reason like a scientist as infrastructure for AI-enabled discovery in fundamental science.

Core design

Specialized fine-tuned models across physics domains; 8B+ parameters; trained on curated scientific corpus.

Key capabilities

Hypothesis generation, symbolic reasoning, tool integration, validation loops, Dynamic Research Objects (DROs) for reproducible steps.

Progress highlights

Early self-guidance achieved to move from question → hypothesis → evaluation; 10+ specialized models; internal experiments running on quantum information questions.

How it's different

Model-layer innovation for rigorous, interpretable reasoning; built with the scientific community to ensure alignment with the scientific process.

10+

Fine-tuned specialized models

8B-1T+

Parameters

Bottleneck

For as long as humans have existed, we’ve tried to understand the world around us. What we’ve learned so far is remarkable, but with progress comes increased complexity.
This is creating an emerging structural challenge where neither human cognition nor existing research systems are able to scale with the growing volume of scientific knowledge being produced.

Shift

The scientific method is also evolving. AI is moving from a tool to a research partner, creating a fundamental shift in how (and where) science is performed. 
Academic research remains structured around human-led workflows, while advances in AI are largely developed outside of systems designed specifically for scientific discovery. The result is a growing gap between how science is conducted and the systems now shaping its future.

A New Approach

Closing this gap requires rethinking how discovery is carried out, not just applying AI to existing workflows. 
FirstPrinciples is a research company focused on advancing AI-enabled discovery in fundamental science. We are building systems centred around the scientific method, enabling new ways to explore the world around us.

Our Core Pillars

Scientific advancement

We enable new modes of discovery by building AI systems that contribute to rigorous, original scientific research.

Shared understanding

We aim to deepen humanity’s understanding of the universe and contribute to shared knowledge that supports long-term progress.

Responsible AI infrastructure

We work closely with the global scientific community to build AI infrastructure that can contribute meaningfully to scientific progress.

Institutional innovation

We are an independent, global company building AI systems designed for scientific discovery and grounded in the standards of rigorous research.

Explorations in Science and AI

Read more

AI system 'Theo Conjecture' solves 35-year-old math conjecture, finds a term no one predicted

An automated discovery system built at FirstPrinciples by Randy Davila has proven a 1989 prediction by Paul Erdős and William Staton linking prime numbers to the Riemann zeta function, and uncovered a second mathematical term that had gone unnoticed for decades.

Lab Notes: CiteVerify - Fake citation detection and evidence verification for AI research

Scientific writing has always relied on the implicit contract that claims must remain traceable to evidence. Large language models complicate that relationship. Modern systems can generate reports that appear rigorous and extensively sourced while quietly introducing fabricated citations. CiteVerify is FirstPrinciples’ answer to the rise of fake citations.

Automated conjecturing: How machines are exploring mathematical structure

Before a theorem can be proved, someone has to decide what is worth proving. For decades, the formation of a conjecture remained largely outside the reach of machines. In Automated Conjecturing with TxGraffiti, Randy Davila explores how that boundary has shifted.

Lab Notes: Teaching models to reason a little better

A recent recap of work at FirstPrinciples, from fine-tuning and RLVR to ensembles and 122B-scale models. We’re beginning to clarify what improves scientific reasoning, and these are our notes.

Between tools and theory: Reflections from the Machine Learning and the Physical Sciences workshop, NeurIPS 2025

A reflection on ML4PS 2025, where researchers in physics and machine learning grappled with the role AI should play in scientific discovery, and what it would take to move from process acceleration toward deeper scientific insight.