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H2

H2 VQE accuracy-cost benchmark · hardware · ibm_pittsburgh

Final energy-1.5658518509hartree
Shots4096
Runtime executionsingle-job
Resilience1
MappingJW
Active space2e,2o

Jordan-Wigner mapping · Shots and precision · Resilience settings

Method

Mapper
JW
Ansatz
UCC
Optimizer
COBYLA
Maximum iterations
30
Best energy (Ha)
-1.56585

Execution

Mode
hardware
Provider
IBM Quantum
Compute resource
ibm_pittsburgh
Resource type
quantum processor
Processor family
Heron
Processor model
ibm_pittsburgh
Processor revision
3
Qubits
156
Connectivity
Not recorded
Runtime execution
single-job
Shots
4096
Precision
0.015625
Resilience
1
Submitted
2026-03-03T15:45:40+01:00
Wall time (s)
627

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
4
Physical qubits
Not recorded
Parameters
Not recorded
Depth
96
Two-qubit gates
48
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)
0.291423
Signed error (Ha)
0.291423
Total QPU time (s)
394
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)
Atomxyz
H000
H000.735

Dataset publication

Associated articles

Compute access

  • Fraunhofer Quantum Now and EQeS · IBM Quantum · allocation: Fraunhofer Quantum Now

Optimization trajectory

23 recorded objective evaluations. Charts use cumulative time so convergence cost remains comparable across calculations.

Download trajectory CSV · Download trajectory JSON

Energy (Ha)
Signed reference error (mHa)
Cumulative quantum time (s)
Cumulative wall time (s)
AttemptOutcomeEnergy (Ha)Elapsed (s)Quantum (s)Parameters
1succeeded -1.375475744125.7311 17—
2succeeded -0.751645013332.2111 17—
3succeeded -0.919450337425.3947 17—
4succeeded -1.217689564025.8037 17—
5succeeded -1.513132870524.583 17—
6succeeded -1.144799120825.9091 17—
7succeeded -1.337048147525.5989 17—
8succeeded -1.359202112424.9614 17—
9succeeded -1.546280805224.9397 17—
10succeeded -1.565394166728.0399 17—
11succeeded -1.535516275725.1433 17—
12succeeded -1.553212048825.3692 17—
13succeeded -1.565851850925.497 17—
14succeeded -1.458293859628.2637 17—
15succeeded -1.541296941126.2744 17—
16succeeded -1.553555600324.985 17—
17succeeded -1.554089053425.5992 17—
18succeeded -1.283876011924.0925 17—
19succeeded -1.564189093755.5508 20—
20succeeded -1.550323580925.6264 17—
21succeeded -1.145771825125.2919 17—
22succeeded -1.425147812525.1902 17—
23succeeded -1.344633937225.187 17—