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H2

H2 VQE accuracy-cost benchmark · hardware · ibm_brussels

Final energy-1.1977283557hartree
Shots256
Runtime executionsingle-job
Resilience2
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)
-1.19773

Execution

Mode
hardware
Provider
IBM Quantum
Compute resource
ibm_brussels
Resource type
ibm quantum hardware
Processor family
Eagle r3
Processor model
Not recorded
Processor revision
Not recorded
Qubits
Not recorded
Connectivity
Not recorded
Runtime execution
single-job
Shots
256
Precision
0.0625
Resilience
2
Submitted
2026-03-03T12:57:34+01:00
Wall time (s)
346

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)
0.659547
Signed error (Ha)
0.659547
Total QPU time (s)
216
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

19 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 -1.163079222017.8071 11—
2succeeded -0.977050671020.5802 13—
3succeeded -1.001942390317.5382 11—
4succeeded -0.860442841817.774 11—
5succeeded -1.056606007217.6854 11—
6succeeded -1.119110710817.7036 11—
7succeeded -1.010321059517.8762 11—
8succeeded -0.863919090917.9604 11—
9succeeded -0.812717978717.6233 11—
10succeeded -1.197728355717.7746 11—
11succeeded -0.875516478017.7821 11—
12succeeded -1.060331533420.4737 14—
13succeeded -1.191653906219.9081 13—
14succeeded -0.760348795017.638 11—
15succeeded -1.024653933317.6995 11—
16succeeded -1.067497201218.1637 11—
17succeeded -0.781024329117.5929 11—
18succeeded -0.976780157218.017 11—
19succeeded -0.925173010218.1731 11—