Pumat Explorer
pumat:record:blake3:1bee32ae81029565100423937a55d7788fc8b8467b0b9af02a60d0dc65f71b49Calculation
- Material
- Si (2 atoms)
- Solver
- quantum-espresso 7.4.1
- Calculation
- scf
- Status
- converged
- Cutoff / k-points
- 30 Ry · 4x4x4
- License
- CC-BY-4.0
Results
- Total energy
- -310.569142 eV
- Fermi / HOMO
- 6.028726552 eV
Reproducibility
- Executions of this calculation
- 1
- Agreement
- UNVERIFIED (agreement between workers is not proof of scientific correctness)
- Calculation ID
- pumat:calc:blake3:7e6fc83595d5cef53d03d11e8c43c4aff241fe2a250a2d464d7a452b9cec759a
- Solver manifest
- sha256:8b9f313c30ca190effbde43d89d95d9bbcdd0d6f16b7baacbe7798868b009d92
- Parser
- sha256:6257a438a3fd7a57705230773f0d25820ec7b547f04e7388a28fd2b9dcdb75f5
- Receipt
- pumat:receipt:blake3:80a93916fed3148c385c8cebbeb77c8406de2eb0a0917185200c4e5a5fc6827e
- Publisher / worker
- 12D3Ko…ZZcg / 12D3Ko…KFfj
- Created
- 2026-10-02T06:55:45Z
Downloads
| File | SHA-256 | Size |
|---|---|---|
| manifest.json | signed publication manifest | |
| input/Si.pbe-n-rrkjus_psl.1.0.0.UPF | 669fb75395a9… | 1513204 |
| input/canonical-job.json | c2c1c8b051ad… | 1144 |
| input/dependencies.json | 7fd21a4acf87… | 205 |
| input/silicon.cif | 37c7369b1dc5… | 482 |
| output/data-file-schema.xml | 5e7dc71f6f82… | 32165 |
| output/stderr.txt | e3b0c44298fc… | 0 |
| output/stdout.txt | a089dd80ff42… | 12916 |
| parsed/result.json | c9d65f7d81b2… | 1579 |
| provenance/execution-environment.json | ed3e01552e33… | 592 |
| provenance/lease.json | c4df41bca36b… | 2149 |
| provenance/receipt-acceptance.json | d7b0f517806e… | 1069 |
| provenance/receipt-completion.json | 446d7459f54d… | 1845 |
| provenance/solver-manifest.json | 560a9561c071… | 1981 |