Method
- Mapper
- PT
- Ansatz
- UCC
- Optimizer
- COBYLA
- Maximum iterations
- 30
- Best energy (Ha)
- -1.8458
H2
H2 VQE accuracy-cost benchmark · hardware · ibm_kingston
Final energy-1.8300754618hartree
Shots4096
Runtime executionsession
Resilience0
MappingPT
Active space2e,2o
Parity mapping with full symmetry tapering · Shots and precision · Resilience settings
Execution
- Mode
- hardware
- Provider
- IBM Quantum
- Compute resource
- ibm_kingston
- Resource type
- ibm quantum hardware
- Processor family
- Heron r2
- Processor model
- Not recorded
- Processor revision
- Not recorded
- Qubits
- Not recorded
- Connectivity
- Not recorded
- Runtime execution
- session
- Shots
- 4096
- Precision
- 0.015625
- Resilience
- 0
- Submitted
- 2025-12-16T16:24:37+01:00
- Wall time (s)
- 181
Molecular system
- Charge
- 0
- Multiplicity
- 1
- Basis
- STO-3G
- Active space
- 2e,2o
- Active electrons
- 2
- Spatial orbitals
- 2
- Active orbital indices
- Not recorded
- Geometry units
- angstrom
Circuit
- Logical qubits
- 1
- Physical qubits
- Not recorded
- Parameters
- Not recorded
- Depth
- 1
- Two-qubit gates
- 0
- Hamiltonian terms
- Not recorded
Scientific provenance
- Cohort
- published h2
- Reference method
- exact diagonalization
- Reference energy (Ha)
- -1.85728
- Energy convention
- Published H2 benchmark electronic-energy convention
- Absolute error (Ha)
- 0.0271996
- Signed error (Ha)
- 0.0271996
- Total QPU time (s)
- 57
- Calibration time
- Not recorded
- Mean readout error
- Not recorded
- Mean two-qubit gate error
- Not recorded
Software
- Qiskit
- 1.4.3
- Qiskit Aer
- 0.17.1
- Qiskit Algorithms
- 0.3.1
- Qiskit Ibm Runtime
- 0.40.1
- Qiskit Nature
- 0.7.2
- Qiskit Nature Pyscf
- 0.4.0
Molecular geometry (angstrom)
| Atom | x | y | z |
|---|---|---|---|
| H | 0 | 0 | 0 |
| H | 0 | 0 | 0.735 |
Dataset publication
Associated articles
- Accuracy-Cost Trade-offs for Reference VQE Calculations of H2 on IBM Quantum Hardware submitted to Quantum Science and Technology
- Accuracy-Cost Trade-offs for Reference VQE Calculations of H2 on IBM Quantum Hardware DOI 10.48550/arXiv.2604.11478 arXiv 2604.11478 published preprint
Compute access
- Fraunhofer Quantum Now and EQeS · IBM Quantum · allocation: Fraunhofer Quantum Now
Optimization trajectory
19 recorded objective evaluations. Charts use cumulative time so convergence cost remains comparable across calculations.
Download trajectory CSV · Download trajectory JSON
| Attempt | Outcome | Energy (Ha) | Elapsed (s) | Quantum (s) | Parameters |
|---|---|---|---|---|---|
| 1 | succeeded | -1.8308933092 | 3454.36 | 3 | — |
| 2 | succeeded | -0.5902612092 | 8.33077 | 3 | — |
| 3 | succeeded | -0.8561947186 | 9.04041 | 3 | — |
| 4 | succeeded | -1.5893411723 | 8.82762 | 3 | — |
| 5 | succeeded | -1.6467551713 | 8.54151 | 3 | — |
| 6 | succeeded | -1.8406010098 | 9.70625 | 3 | — |
| 7 | succeeded | -1.8042071195 | 9.11421 | 3 | — |
| 8 | succeeded | -1.8324645865 | 8.43465 | 3 | — |
| 9 | succeeded | -1.8398384163 | 9.87711 | 3 | — |
| 10 | succeeded | -1.8457971261 | 8.41096 | 3 | — |
| 11 | succeeded | -1.8345111567 | 8.50691 | 3 | — |
| 12 | succeeded | -1.8453922582 | 8.45632 | 3 | — |
| 13 | succeeded | -1.8290662617 | 9.22814 | 3 | — |
| 14 | succeeded | -1.8245460227 | 8.73085 | 3 | — |
| 15 | succeeded | -1.8456366926 | 8.65434 | 3 | — |
| 16 | succeeded | -1.8305339885 | 9.5432 | 3 | — |
| 17 | succeeded | -1.8422459704 | 9.4564 | 3 | — |
| 18 | succeeded | -1.8295985057 | 9.34799 | 3 | — |
| 19 | succeeded | -1.8300754618 | 9.88978 | 3 | — |