All tools
Tools · Quantum Chemistry
Qiskit SQD
Active-space ground-state energies by sample-based quantum diagonalization on the Qiskit Aer simulator
Hardware and price
Price per run
What a typical run reserves from your wallet: the catalog's expected runtime on each piece of hardware × your plan's per-second rate. Larger inputs reserve more, and you're charged only for the seconds the job actually runs.
| Hardware | Typical runtime | Basic | Starter | Pro | Enterprise |
|---|---|---|---|---|---|
| CPUDefault | 30 min | $0.25 | $0.14 | $0.09 | $0.054 |
In workflows
Chain it with other steps.
Each input and output has a data kind, so the builder only connects steps that fit.
Inputs
- MoleculesSDF, MOL, MOLBLOCK
Outputs
- ArchiveZIP
- TableCSV
References
The method behind it.
- Javier Robledo-Moreno, Mario Motta, Holger Haas et al. (2025). Chemistry beyond the scale of exact diagonalization on a quantum-centric supercomputer. Science Advances. doi:10.1126/sciadv.adu9991 (opens in a new tab)
- Mario Motta, Kevin J. Sung, K. Birgitta Whaley et al. (2023). Bridging physical intuition and hardware efficiency for correlated electronic states: the local unitary cluster Jastrow ansatz for electronic structure. Chemical Science. doi:10.1039/d3sc02516k (opens in a new tab)
- Ali Javadi-Abhari, Matthew Treinish, Kevin Krsulich et al. (2024). Quantum computing with Qiskit. arXiv. doi:10.48550/arxiv.2405.08810 (opens in a new tab)
Run via API
Submit it from your own code.
Use an API key from your account. The estimate uses your plan's rates; submitting reserves that amount from your wallet.
# Estimate the reservation for your plan (payload fields: see the API reference)
curl -X POST https://api.cognichem.com/api/v1/jobs/estimate \
-H "X-Api-Key: $COGNICHEM_API_KEY" \
-H "Content-Type: application/json" \
-d '{"job_type": "qiskit-sqd", "resource": "cpu", "payload": {}}'
# Submit (retrying with the same Idempotency-Key never submits twice)
curl -X POST https://api.cognichem.com/api/v1/jobs/submit \
-H "X-Api-Key: $COGNICHEM_API_KEY" \
-H "Idempotency-Key: $(uuidgen)" \
-H "Content-Type: application/json" \
-d '{"job_name": "qiskit-sqd-1", "job_type": "qiskit-sqd", "resource": "cpu", "payload": { ... }}'Quantum Chemistry
Related tools
- PySCF Electronic Structure
Hartree–Fock, DFT, TDDFT, optimization, frequencies, and charges with PySCF / GPU4PySCF