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Record W4226332502 · doi:10.1103/physreva.105.042403

Learning quantum dynamics with latent neural ordinary differential equations 

2022· article· en· W4226332502 on OpenAlexafffund
Matthew Choi, Daniel Flam-Shepherd, Thi Ha Kyaw, Alán Aspuru‐Guzik

Bibliographic record

VenuePhysical review. A/Physical review, A · 2022
Typearticle
Languageen
FieldComputer Science
TopicQuantum Computing Algorithms and Architecture
Canadian institutionsCanadian Institute for Advanced ResearchVector InstituteUniversity of Toronto
FundersUniversity of TorontoCanada Foundation for InnovationGovernment of Ontario
KeywordsMaster equationCurse of dimensionalityOrdinary differential equationOdePhysical lawStatistical physicsVon Neumann architectureQuantum dynamicsUncertainty principleQuantumComputer scienceOpen quantum systemPhysicsClassical mechanicsDifferential equationApplied mathematicsMathematicsArtificial intelligenceQuantum mechanics

Abstract

fetched live from OpenAlex

The core objective of machine-assisted scientific discovery is to learn physical laws from experimental data without prior knowledge of the systems in question. In the area of quantum physics, making progress towards these goals is significantly more challenging due to the curse of dimensionality as well as the counterintuitive nature of quantum mechanics. Here we present the QNODE, a latent neural ordinary differential equation (ODE) trained on expectation values of closed and open-quantum-systems dynamics. It can learn to generate such measurement data and extrapolate outside of its training region that satisfies the von Neumann and time-local Lindblad master equations for closed and open quantum systems, respectively, in an unsupervised means. Furthermore, the QNODE rediscovers quantum-mechanical laws such as the Heisenberg's uncertainty principle in a data-driven way, without any constraint or guidance. Additionally, we show that trajectories that are generated from the QNODE that are close in its latent space have similar quantum dynamics while preserving the physics of the training system.

Fetched live from OpenAlex and de-inverted. Abstracts are not stored in this database: the inverted indexes are 8.6 GB of the frame’s 9.3 GB of text, and the host has 13 GB free.

How this classification was reachedexpand

Full frame machine prediction

Teacher imitation

Not calibrated prevalence, not ground truth. Human validation pending. The Gemma side is a direct model label for every work in the frame, read from the title-only record. The Codex side is a classifier learned from the 10,348 direct Codex labels and calibrated to design-weighted sample rates; fields without enough sample support carry no Codex call. Candidate is the union of the two sides; consensus is their intersection. These outputs are machine_predicted_unvalidated and are not human labels.

metaresearch head score (Codex)0.001
metaresearch head score (Gemma)0.004
Version: metacan-v3-hybrid-931329e0061cValidation status: machine_predicted_unvalidated
Candidate categoriesnone
Consensus categoriesnone
DomainCandidate signal: none · Consensus signal: none
Study designCandidate signal: Simulation or modeling · Consensus signal: Simulation or modeling
GenreCandidate signal: Empirical · Consensus signal: none
Teacher disagreement score0.003
Threshold uncertainty score0.006

Distilled classifier scores by category (both heads)

CategoryCodexGemma
Metaresearch0.0010.004
Meta-epidemiology (narrow)0.0000.000
Meta-epidemiology (broad)0.0010.001
Bibliometrics0.0000.000
Science and technology studies0.0000.001
Scholarly communication0.0010.002
Open science0.0010.002
Research integrity0.0010.002
Insufficient payload (model declined to judge)0.0010.000

Machine scores (provisional)

The two teacher heads of the student model, read on this work. A score orders the frame for review; it never asserts a category, and the validation status ships verbatim with every row.

Baseline scores from an immature model (maturity gate not passed, 7 training rounds). Scores rank; they never assert a category.

Opus teacher head0.013
GPT teacher head0.302
Teacher spread0.290 · how far apart the two teachers sit on this one work
Validation statusscore_only:v0-immature-baseline · verbatim from the scoring run: score_only means the number may rank works, and no category label ships from it

Classification

machine, unvalidated

Machine predicted; a candidate call from one source (direct Gemma or distilled Codex), not a consensus.

The models applied no category: nothing in the taxonomy fit this work.
Study designSimulation or modeling
Domainnot available
GenreEmpirical

How this classification was reached, model by model and score by score, is at the end of the page under "How this classification was reached".

Quick stats

Citations30
Published2022
Admission routes2
Has abstractyes

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