Demo record. Built 2026-10-23, fact-checked 2026-10-24 after reviews by two AI models from different providers and a check of load-bearing facts against primary sources, amended 2026-10-31: binding per team and an ablation in every quantum dossier, as the record's history states. No domain expert has reviewed it yet. Draft protocol, not yet registered.

The question behind it. Can quantum computing beat the best classical methods on biologically relevant molecules? That question is too broad to resolve as stated, so this record commits to one narrow piece of it that a public benchmark can decide.

The hypothesis

Can quantum assistance halve the time to a verified iron-sulfur benchmark result?

Speculation current tier Draft rule: only results after registration can count

For the fixed Fe₄S₄ molecular model specified below, a workflow using quantum hardware can produce a verifiable variational state meeting the stated energy target at least twice as fast as the strongest publicly tested classical workflow, under the same execution-budget ceiling.

System

An iron-sulfur cluster model with 54 electrons in 36 orbitals, pinned to one public file

Comparator

The strongest publicly tested classical workflows for the same target, under the same budget

Endpoint

Elapsed time to a verified state at or below −327.245436 hartree

Tested

Solver performance: speed and quality on one fixed mathematical problem

Not tested

Chemical prediction: agreement with a physical measurement

Not tested

Biological usefulness: whether a result changes an experimental decision

Why this tier. Under this draft rule only results produced after registration can count, so the tier rests on what has been reported so far. On this exact model, the best quantum-hardware energy posted to the public Quantum Advantage Tracker is −326.913 hartree (IBM and RIKEN, November 2025), about 0.33 hartree above this record's target; classical entries there and in the 2026 GPU DMRG work reach lower. More broadly, Wellcome Leap's April 2026 announcement names no winner of its $5 million prize for quantum advantage over best-in-class classical baselines; the largest 2026 hybrid calculation on a protein system states that its authors do not regard it as the basis of an advantage claim; and an 18-author analysis found no evidence yet for generic exponential advantage in ground-state energy estimation, while leaving polynomial speedups open. This is a bounded review finding, not a proof that no such result exists.

What would change it

One test, to be committed before any result

Every possible result maps to a tier in advance. The classical side keeps improving, so the bound quantum result stays public for at least 180 days before it is judged, and every classical answer published by the cutoff counts.

Twice as fast to a verified Fe₄S₄ state, at a matched budget

Draft protocol, not registered Bound result due 2027-07-04 · judged 2027-12-31
System

The synthetic cluster [Fe₄S₄(SCH₃)₄]²⁻, as the fixed CAS(54 electrons, 36 spatial orbitals) Hamiltonian in the Li and Chan active-space repository, revision 84433831a680f70665cf43fc8692e0210da92be3, file Fe2S2_and_Fe4S4/Fe4S4/fe4s4, SHA-256 0b840102a4894fee4648944f2bf3bb5d85828deb4b7e71b964136bbc4c9e01ce. 54 electrons, total spin S = 0. Energies are reported in this file's convention. A different Hamiltonian, active space or spin sector is a different test.

The same Hamiltonian, written in a different orbital basis, is the Fe₄S₄ (54 electrons, 36 orbitals) instance on the public Quantum Advantage Tracker's variational track, so its posted energies are directly comparable. Counted executions read the pinned file. Rotating its orbitals within the active space, for example into the tracker's basis, is input processing and counts toward the run; a Hamiltonian regenerated from a different calculation is a different input.

Intervention

A workflow that runs circuits on quantum hardware and uses their measured outputs to build a compact, classically checkable variational state. It includes input processing, task-specific optimization, circuit preparation, quantum execution, error handling, classical processing, state construction and energy verification. Resource estimates and simulated quantum runs do not count as hardware results.

Comparator

Every eligible public classical workflow for the same target. Coverage must include GPU-accelerated DMRG, selected configuration interaction, and the hybrid pipeline with its quantum sampling stage replaced by a classical method. Each contender may use its strongest documented implementation within the common budget and need not imitate the quantum algorithm. "Strongest" means strongest among the publicly tested contenders, not optimal over all possible algorithms.

A classical contender counts when it publishes, before the cutoff, the same records for ten cold-start runs on this input: input identifiers, software versions, protocol, hardware identification, raw logs, resource and pricing records, all ten outcomes and a verifier. Its protocol and runs may predate this record's registration. If a required comparator family has no eligible contender by the cutoff, the comparison is inconclusive.

Matched resources

Each complete execution has a ceiling of US$100,000 in compute-access charges and 168 hours of elapsed execution time. Both sides are valued at publicly archived rental prices or published commercial quotations on the comparison date; donated or internal access is valued the same way. Counted: quantum and classical resources, task-specific tuning, retries, data movement, state reconstruction and verification. Not counted: general software development and scientific review labor. External queue delays are reported separately. This is a purchasing-budget ceiling, not a claim of equal physical resources.

Endpoint

Elapsed execution time from the fixed Hamiltonian input to a verified, normalized singlet state whose active-space energy upper bound is at most −327.245436 hartree. That target is the reference energy, −327.247036 hartree, plus 0.0016 hartree. The reference is the lowest published, non-extrapolated variational upper bound for the S = 0 state on the pinned file before this record's registration: today, spin-adapted DMRG with entanglement-minimized orbitals at bond dimension 20,000, spin isomer BS3 (Zhai et al., arXiv 2601.04621, supplementary section 4.1, the same in v1 and v2). The reference is frozen at registration; lower bounds published later enter the comparison and do not move the target. It stays provisional until registration confirms the spin sector and that the paper's file matches the pinned bytes. The 0.0016 hartree margin is a tolerance above a variational bound, not chemical accuracy relative to the exact energy or a claim of experimental accuracy. Any verified, normalized state in the S = 0 space counts, whatever its spin-coupling pattern.

Runs and threshold

Each workflow performs ten consecutive cold-start executions under a protocol disclosed before they begin. Every attempt is recorded; failed runs are not replaced. Every quantum dossier also includes an ablation: the same workflow, code, execution policy and classical hardware class, with every quantum-hardware output replaced by a classical source declared in the protocol before the counted runs begin. The protocol names each replaced interface and, for each, the encoding, measurement basis, distribution and constraints of the classical source and how every adaptive call is answered; the source is at least uniform over the declared sample space under the same particle-number and spin-projection constraints, and a stronger classical sampler may be declared as well. The ablation runs ten times cold-start under the same ceilings, is recorded the same way, and the cost of generating the classical source counts toward its execution. A complete, eligible ten-run ablation populates the comparator family of the hybrid pipeline with its quantum sampling stage replaced by a classical method, whether or not any of its runs succeeds; its successful executions within both ceilings enter the speed-score comparison as classical contenders. The final singlet verification is unchanged. Each quantum execution must meet the energy target within both ceilings, with a published deterministic error bound of at most 10⁻⁶ hartree on its energy. A dossier is positive when it meets this ten-run requirement and its speed score's conservative lower bound is at least 2.0.

The speed score is the fastest successful classical execution divided by the slowest of the ten quantum executions. Its bounds come only from the timestamp uncertainty stated in the published execution logs; no statistical interval is taken over runs, because the score already uses the fastest classical and the slowest quantum execution. It passes when its conservative lower bound is at least 2.0, fails when its conservative upper bound is below 2.0, and is inconclusive when it spans 2.0. A quantum timeout or budget overrun fails the ten-run requirement. If no classical contender reaches the target, the comparison is inconclusive.

Challenge window

Judgment happens once, at the 2027-12-31 cutoff. A quantum dossier can bind only if it has been complete and public for at least 180 days by then, which means public by 2027-07-04 at 23:59 UTC. Every eligible classical result public before the cutoff enters the comparison, including methods published after the quantum result. A potentially decisive classical result whose accounting is still unresolved at the cutoff makes the comparison inconclusive for each bound dossier it could decide; unresolved accounting that affects one dossier does not veto another.

Eligibility

A quantum dossier is eligible when it publishes immutable input identifiers, software versions, the execution protocol, hardware identification, raw execution logs, resource and pricing records, all ten outcomes, the ten ablation outcomes with their declared classical source, a reproducible verifier, and a team declaration: the team's members, controlling organization and project-specific funding, under the same criteria as the independence rule. Its protocol must carry a public timestamp after this record is registered and before the counted runs begin.

Not eligible: the wrong molecular problem, simulation presented as hardware, missing required records, including the ablation records and the team declaration, or quantum runs begun before the timestamp. Eligible but inconclusive: complete evidence with unresolved bounds, conflicting verification or an unresolved deciding comparison. Missing documentation is never treated as evidence that the quantum method lost.

Binding

Each team's earliest eligible quantum dossier binds for that team, including an unsuccessful one, if it is complete and public by 2027-07-04 at 23:59 UTC. The 180 days count from the moment the complete dossier is public. A later, more favorable dossier from the same team does not replace it; within a team, identical public timestamps are ordered by permanent source identifier. At both stages, binding and selection, permanent source identifier strings are compared in ascending UTF-16 code-unit order, without locale collation, and timestamps are compared as instants with every published fractional digit. Groups that share scientific authors, a controlling organization or project-specific funding, judged by the independence rule's criteria and applied through every overlapping group, count as one team, and team declarations are checked before binding. A dossier from one team never prevents another team's dossier from binding.

The test resolves on one bound dossier, chosen by rule: a positive dossier over a non-positive one; among positive dossiers, the one whose own outcome ranks highest, Established over Active debate over awaiting confirmation, then the one with more independent positive confirmations, then the higher conservative lower bound of the speed score, then the earlier public timestamp, identical timestamps ordered by permanent source identifier. With no positive dossier, the outcome is inconclusive if any bound dossier is inconclusive, and threshold-not-met only if every bound dossier failed. Every bound dossier stays on the record with its confirmations, contradictions and selection disposition, and evidence against the shared verifier, Hamiltonian or classical comparison is assessed against every dossier it affects.

Independence

An independent confirmation requires newly executed runs, new measurement data, independent analysis and an independently reproduced energy check. The confirming group shares no scientific authors, controlling organization or project-specific funding with the original team or another counted confirming group, and declares its affiliations, funding and competing interests. A common general-purpose funder or a commercially available hardware provider does not by itself break independence; shared hardware, software and provider help must be disclosed. Reviewing the original data or serving on a prize panel is an audit, not an independent execution.

A positive confirmation is a new execution of a bound workflow on the same input, by a group meeting the independence rule and the same eligibility rules, whose speed score has a conservative lower bound of at least 2.0. A decisive contradictory reproduction is a new execution of a bound workflow on the same input, by a group meeting the same rules, whose speed score has a conservative upper bound below 2.0, or that fails the ten-run requirement. Both run on the same hardware class as the dossier they confirm or contradict, or one its authors name as equivalent. Both count if their complete dossiers are public by the cutoff, and both are compared against the same classical results. Confirmations and contradictory reproductions are counted per bound dossier; the outcome is applied to the dossier the binding rule selects.

Who runs it

Research teams run and publish the executions. No team is represented as having agreed to take part. Violema keeps the record and applies the published rule; numerical checks must be reproducible from the public dossier by evaluators independent of the reporting team.

Deadline

Each bound quantum dossier must be complete and public by 2027-07-04 at 23:59 UTC. Confirmations and contradictory reproductions must be complete and public by the cutoff, 2027-12-31 at 23:59 UTC, when the outcome is applied once. With no bound dossier, the test lapses: no eligible result, never a negative one. Any other quantum claim made public after 2027-07-04, and any evidence after the cutoff, go into a new dated assessment, and the frozen outcome stays visible.

The molecular input and the reference energy come from published work. The rule that selects the reference, the energy margin, budget, run count, speed margin, 180-day window, deadline, independence rules, team binding, the ablation requirement and tier moves are Violema's policy choices, not field consensus.

Applied once, at the cutoff, after every admissible comparison is in. The three positive outcomes apply to the resolving dossier, the bound dossier the binding rule selects; the other three apply to the bound dossiers together. The outcomes do not overlap. Each carries a rule id, so a result can cite the outcome it triggered.

The resolving dossier is positive, it has at least two independent positive confirmations, and no decisive contradictory reproduction of it exists.

Moves to Established, for this benchmark only o-established-benchmark

The resolving dossier is positive, and at least one decisive contradictory reproduction of it exists.

Moves to Active debate, for this benchmark only o-contested

The resolving dossier is positive, with fewer than two independent positive confirmations and no decisive contradictory reproduction of it. The positive result is shown on the record with its confirmation count.

Stays Speculation o-positive-awaiting-confirmation

Every bound dossier fails: its speed score's conservative upper bound is below 2.0, or it fails the ten-run requirement.

Stays Speculation; threshold not shown o-threshold-not-met

No bound dossier is positive, and at least one is eligible but inconclusive: for example, a speed score whose bounds span 2.0, a required comparator family with no eligible contender, or unresolved accounting.

Stays Speculation; inconclusive o-otherwise

No dossier is bound: none from any team was complete, eligible and public by 2027-07-04.

Stays Speculation; lapsed o-lapsed
The decision this record serves

Whether a quantum-assisted workflow has earned an independent reproduction

A positive result here would support funding an independent reproduction, and then a benchmark closer to a biological decision. It would not by itself support claims about drug efficacy, patient outcomes or broad biological advantage. Three indicators help a group decide where to put effort.

Problem class

Where hybrid methods show gains first: open-shell metal clusters and excited states, or closed-shell energies where classical methods are already strong.

Changes which projects get quantum time.

Quantum contribution

The gap between a hybrid workflow and the same pipeline with its quantum sampling replaced by a classical method. In 2025 a classical method matched one quantum iron-sulfur result outright. On the other side, the Algorithmiq, IBM and Cleveland Clinic team describes a quantum-assisted DMRG workflow for a photosensitizer; whether it beats DMRG at equal total resources is the open question.

Changes whether to scale quantum runtime or invest in the classical steps doing the work.

Classical response time

How long classical methods take to answer each new hardware claim. In 2023 the answer came in under two weeks.

Changes how much weight a fresh claim deserves before its challenge window closes.

These are proposed indicators for a reader's own decisions, not findings about any group's plans.

Conflicts of interest

The same rules for every team

Cited work comes from IBM, RIKEN, Algorithmiq, Cleveland Clinic and university groups. IBM and Algorithmiq also sell the hardware and software involved. These interests are disclosed as context, not as grounds to exclude any work, and the same eligibility, comparison and disclosure rules apply to every team.

Violema's own interest: it is a company that builds evidence records, and this record is a demonstration of that work.

Feedback from any institution whose work is cited is stakeholder review. It does not count as independent confirmation or as endorsement of this record. No individual's participation is inferred from an institution's name.

Evidence time

What the field has shown, in the order it became public

Dates are each work's first public version (preprint or announcement), not its journal year. Where a later version carries the figure quoted, that is stated. The cost estimates are point values under each paper's own hardware assumptions and measure different things, so they are listed rather than charted. Each entry is an observation; in a full map it would be a claim with its own tier.

Fault-tolerant estimate Hardware run Classical result or analysis Program or other
  1. 2016-05-11

    Reiher et al.

    PNAS 2017 · arXiv 1605.03590

    A fault-tolerant resource estimate for simulating FeMoco, the iron-molybdenum cofactor of nitrogenase, with error-correction overhead included. An estimate, not a run or a classical comparison.

    Fault-tolerant estimate
  2. 2018-09-27

    Li et al.

    J. Chem. Phys. 2019 · arXiv 1809.10307

    Found that the FeMoco active space used in the 2016 estimate gives a qualitatively incorrect ground state, and built a larger model with 113 electrons in 76 orbitals.

    Classical result
  3. 2019-02-06

    Berry et al.

    Quantum 2019 · arXiv 1902.02134

    New algorithms for chemistry on a fault-tolerant machine. The version of 2019-10-01 estimates about 700 times less surface-code spacetime volume for FeMoco than earlier quantum algorithms, using the larger 2018 model; the first version gave no such factor.

    Fault-tolerant estimate
  4. 2020-11-06

    Lee et al.

    PRX Quantum 2021 · arXiv 2011.03494

    A projected cost for FeMoco: about 4 million physical qubits and under 4 days, assuming 1 μs cycle times and physical gate error rates no worse than 0.1%. An estimate, not a run.

    Fault-tolerant estimate
  5. 2022-08-03

    Lee et al.

    Nature Communications 2023 · arXiv 2208.02199 · 18 authors

    An analysis of whether there is evidence for exponential quantum advantage in ground-state energy estimation. It concludes that such evidence has yet to be found across chemical space. It does not consider other tasks and does not rule out polynomial speedups.

    Analysis
  6. 2023-06-14

    Kim et al.

    Nature 618:500 (2023)

    A 127-qubit experiment that IBM presented as evidence of the utility of quantum computing before fault tolerance. It concerns a spin model, not a molecule.

    Hardware run
  7. 2023-06-26

    Tindall et al.; Begušić and Chan

    arXiv 2306.14887 (PRX Quantum 2024) · arXiv 2306.16372, posted 2023-06-28

    Classical simulations of that experiment, posted within two weeks of it. This is why the test makes a quantum result wait at least 180 days before it is judged, and counts every classical answer public by the cutoff.

    Classical result
  8. 2024-05-08

    Robledo-Moreno et al.

    arXiv 2405.05068

    Sample-based quantum diagonalization (SQD) on quantum hardware, applied to nitrogen and iron-sulfur clusters. Going beyond exact diagonalization is not the same as beating the strongest approximate classical solver.

    Hardware run
  9. 2025-01-10

    Caesura et al.

    PRX Quantum 6:030337 (2025) · arXiv 2501.06165

    A fault-tolerant estimate on cytochrome P450, an enzyme family central to drug metabolism: about two orders of magnitude faster (233 times for P450) than an earlier algorithm on baseline photonic hardware without Active Volume support. Active Volume compilation, which suits only some hardware, contributes a factor of about 25 of that. An erratum published 2026-10-08 corrects circuit diagrams and says the correction does not change the resource estimates.

    Fault-tolerant estimate
  10. 2025-01-13

    Reinholdt et al.

    arXiv 2501.07231

    A critical analysis of quantum-selected configuration interaction, the idea behind SQD, finding that sampling efficiency and determinant selection limit it in the systems studied.

    Analysis
  11. 2025-10-31

    Shirakawa et al.

    arXiv 2511.00224 · IBM and RIKEN, 21 authors

    Closed-loop sample-based quantum diagonalization on IBM Heron processors with up to 152,064 nodes of the Fugaku supercomputer. For this [4Fe-4S] (54 electrons, 36 orbitals) model it used 77 qubits and a 1010-determinant subspace, reaching −326.912 hartree, 278 mEh lower than the team's 2024 result. The authors describe its accuracy as comparable to some all-classical approximation methods. This is the result behind the tracker's SQD entry below.

    Hardware run
  12. 2025-11-11

    Quantum Advantage Tracker, variational track

    Public tracker of advantage candidates

    The tracker lists this record's Fe₄S₄ model (the same Hamiltonian in a different orbital basis). An IBM and RIKEN SQD entry, posted 2025-11-11, reports −326.913 hartree on 77 qubits, with 10 hours of quantum processor time and 10 hours on 76,032 Fugaku nodes; the submission and its preprint describe the two phases as overlapping. The tracker files this instance under its baseline benchmarks, with no active advantage candidate.

    Program or other
  13. 2025-11-18

    Zhang and Otten

    arXiv 2511.14734

    A classical method seeded with random determinants (TrimCI) matched a recent quantum SQD energy for a [4Fe-4S] cluster with roughly a million times fewer determinants and CPU-hours.

    Classical result
  14. 2025-11-20

    TrimCI entries on the tracker

    Quantum Advantage Tracker, variational track

    The TrimCI group posts classical entries on the same tracker model, matching the SQD energy (−326.913 hartree) and reaching −327.175 hartree.

    Classical result
  15. 2025-11-30

    Raisuddin et al.

    arXiv 2512.01012

    A benchmark of SQD across the W4-11 thermochemistry set, which found uneven accuracy across reaction types.

    Analysis
  16. 2026-01-08

    Zhai et al.

    arXiv 2601.04621 · v2 2026-06-22

    A classical simulation of the FeMo-cofactor model to chemical accuracy, from the Chan group. Its benchmark uses this record's pinned [Fe₄S₄(SCH₃)₄]²⁻ (54 electrons, 36 orbitals) file and reports spin-adapted DMRG upper bounds down to −327.247036 hartree for the lowest of three spin isomers, with entanglement-minimized orbitals at bond dimension 20,000. That bound is this record's reference energy. Legeza et al. compare their result only with Zhai's values for one isomer, −327.244001 and an extrapolated −327.245273.

    Classical result
  17. 2026-03-30

    Legeza et al.

    arXiv 2603.28648

    GPU-accelerated DMRG on the Fe₄S₄ CAS(54,36) model reached −327.24466 hartree at bond dimension 12,288, in about 12.6 hours on one DGX B200 node: 2.38 mEh above this record's reference. The paper cites the model of Sharma et al. 2014 and does not name an integral file; that it used the pinned Hamiltonian is inferred from agreement with results on the pinned file, not stated by the authors.

    Classical result
  18. 2026-04-16

    Wellcome Leap, Quantum for Bio

    Program outcome · program launched March 2023

    The announcement names no winner of the $5 million grand prize for quantum advantage. A team led by Algorithmiq, with IBM and Cleveland Clinic, won the $2 million prize for running its photosensitizer workflow on more than 50 qubits at program depth of order 10³ to 10⁴, with a path toward advantage. Wellcome Leap expects a follow-on program.

    Program outcome
  19. 2026-05-01

    Merz et al.

    arXiv 2605.01138 · revised 2026-09-05 · Gordon Bell Prize finalist, 2026-09-09

    A Cleveland Clinic, RIKEN and IBM team ran a fragmented hybrid quantum-classical calculation on protein systems of up to 12,635 atoms, using IBM Heron processors with the Fugaku and Miyabi-G supercomputers. The largest circuit used 94 qubits and 5,758 two-qubit gates. The authors state that they do not regard the results as the basis of a quantum advantage claim.

    Hardware run
  20. 2026-07-23

    Belagali et al.

    arXiv 2607.21337

    A fast classical evaluation of single-layer UCJ circuits, a circuit family used in SQD workflows.

    Classical result
  21. 2026-07-27

    Three IBM-related advantage claims

    arXiv 2607.24937 · 2607.25941 · 2607.25998, posted 2026-07-27 and 28

    Advantage claims on spin models and sampling tasks. They concern problems other than biological molecules, so they do not bear on this test.

    Other problems
Map time

This record's own history

2026-10-23Claim and test drafted for a demo.
2026-10-24Revised after reviews by two AI models from different providers, a check of load-bearing facts against primary sources, and a further check of the page itself. The test is now a finished design; the timeline was corrected and extended. No domain expert has reviewed it yet.
2026-10-24Two results added after a further review against the papers and the tracker: Shirakawa et al., the preprint behind the tracker's SQD entry, and Zhai et al. Reported runtimes added to the tracker entry. The test and its outcome rule are unchanged.
2026-10-24Wording corrected after a further review: the input rule now says that rotating the pinned file's orbitals within the active space counts as input processing; the tracker entry says its submission and preprint describe the quantum and classical phases as overlapping; Zhai et al.'s lowest bound on the pinned file, below the reference, is stated, with the reference left as drafted pending review; the outcome rule explains its ids; the conflict-of-interest note no longer says whom the demo was prepared for. The energy target, budget, speed score and outcome rule are unchanged.
2026-10-25Reference energy set by rule: the lowest published, non-extrapolated variational bound for the S = 0 state on the pinned file, frozen at registration. It moved from the GPU DMRG value (−327.24466) to Zhai et al.'s bound (−327.247036), and the energy target moved from −327.24306 to −327.245436. Decided after a review by an AI model from another provider and a simulated domain referee both recommended it; made before registration, when no counted result existed.
2026-10-31Amendment 1, before registration: binding is now per team, so one unsuccessful dossier can no longer lock the test for everyone, and the test resolves on the best bound dossier across teams by a stated rule; every quantum dossier must include an ablation, the same workflow with its quantum outputs replaced by a declared classical source, ten runs under the same ceilings, entering the comparison as a classical contender. Made after a review by a third AI model from another provider found the earliest-dossier rule open to a blocking submission and the comparator rule open to a hybrid pipeline carried by its classical stage; no counted result exists. The energy target, budget, speed score, deadline and tier moves are unchanged.

No outside timestamp yet, so nothing here counts toward a track record. Map time is when the record changed its mind; evidence time is when results appeared.

Underway

What to watch

  • SC26, Chicago, November 15 to 20. The Gordon Bell Prize is presented. The prize decision alone will not resolve this test; its technical results may still be relevant evidence.
  • Wellcome Leap's follow-on to Quantum for Bio. Expected, with no date announced.
  • Registration. This draft becomes a commitment only when its full text receives a public timestamp. Results that predate it cannot count.
Sources

Read for this record

  1. Reiher M, Wiebe N, Svore KM, Wecker D, Troyer M. Elucidating reaction mechanisms on quantum computers. PNAS 114:7555 (2017). arXiv 1605.03590
  2. Li Z, Li J, Dattani NS, Umrigar CJ, Chan GKL. The electronic complexity of the ground-state of the FeMo cofactor of nitrogenase as relevant to quantum simulations. J. Chem. Phys. 150:024302 (2019). doi:10.1063/1.5063376
  3. Berry DW et al. Qubitization of arbitrary basis quantum chemistry leveraging sparsity and low rank factorization. Quantum 3:208 (2019). doi:10.22331/q-2019-12-02-208
  4. Lee J et al. Even more efficient quantum computations of chemistry through tensor hypercontraction. PRX Quantum 2:030305 (2021). doi:10.1103/PRXQuantum.2.030305
  5. Lee S et al. Evaluating the evidence for exponential quantum advantage in ground-state quantum chemistry. Nature Communications 14:1952 (2023). doi:10.1038/s41467-023-37587-6
  6. Kim Y et al. Evidence for the utility of quantum computing before fault tolerance. Nature 618:500 (2023). doi:10.1038/s41586-023-06096-3
  7. Tindall J, Fishman M, Stoudenmire EM, Sels D. Efficient tensor network simulation of IBM's Eagle kicked Ising experiment. PRX Quantum 5:010308 (2024). doi:10.1103/PRXQuantum.5.010308
  8. Begušić T, Chan GKL. arXiv 2306.16372 (2023). arxiv.org/abs/2306.16372
  9. Robledo-Moreno J et al. arXiv 2405.05068 (2024). arxiv.org/abs/2405.05068
  10. Caesura A et al. Faster quantum chemistry simulations on a quantum computer with improved tensor factorization and active volume compilation. PRX Quantum 6:030337 (2025), with erratum PRX Quantum 7:049901 (2026). doi:10.1103/yngp-5fpm; doi:10.1103/f6l1-cdz7
  11. Reinholdt P et al. arXiv 2501.07231 (2025). arxiv.org/abs/2501.07231
  12. Shirakawa T et al. Closed-loop calculations of electronic structure on a quantum processor and a classical supercomputer at full scale. arXiv 2511.00224 (2025). arxiv.org/abs/2511.00224
  13. Zhang H, Otten M. From random determinants to the ground state. arXiv 2511.14734 (2025). arxiv.org/abs/2511.14734
  14. Raisuddin et al. arXiv 2512.01012 (2025). arxiv.org/abs/2512.01012
  15. Zhai H et al. Classical computational simulation of the FeMo-cofactor model to chemical accuracy and its implications. arXiv 2601.04621 (2026; first version 2026-01-08). arxiv.org/abs/2601.04621
  16. Legeza Ö et al. arXiv 2603.28648 (2026). arxiv.org/abs/2603.28648
  17. Wellcome Leap. Quantum for Bio prize outcome, April 16, 2026. wellcomeleap.org
  18. Merz KM Jr. et al. arXiv 2605.01138 (2026), revised 2026-09-05. arxiv.org/abs/2605.01138
  19. Cleveland Clinic newsroom. Cleveland Clinic, RIKEN and IBM team advance to finals for 2026 ACM Gordon Bell Prize. September 9, 2026. newsroom.clevelandclinic.org
  20. Belagali et al. arXiv 2607.21337 (2026). arxiv.org/abs/2607.21337
  21. Leviatan et al., Martiel et al., Barron et al. arXiv 2607.24937, 2607.25941, 2607.25998 (2026).
  22. Quantum Advantage Tracker, variational problems: Fe₄S₄ (54e, 36o). quantum-advantage-tracker.github.io
  23. Li Z, Chan GKL. Active-space models for iron-sulfur clusters, repository revision 84433831. github.com/zhendongli2008