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H2

H2 VQE accuracy-cost benchmark · hardware · ibm_kingston

Final energy-1.8403210799hartree
Shots1024
Runtime executionsession
Resilience2
MappingPT
Active space2e,2o

Parity mapping with full symmetry tapering · Shots and precision · Resilience settings

Method

Mapper
PT
Ansatz
UCC
Optimizer
COBYLA
Maximum iterations
30
Best energy (Ha)
-1.88212

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
1024
Precision
0.03125
Resilience
2
Submitted
2026-02-11T23:07:22+01:00
Wall time (s)
390

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)
0.016954
Signed error (Ha)
0.016954
Total QPU time (s)
209
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 -1.844708025715041.7 11—
2succeeded -0.544003089421.7681 11—
3succeeded -0.836146841119.665 11—
4succeeded -1.661242693320.4775 11—
5succeeded -1.651258565619.4501 11—
6succeeded -1.869995022819.6323 11—
7succeeded -1.798851973219.4361 11—
8succeeded -1.869848299720.3385 11—
9succeeded -1.882120412319.9512 11—
10succeeded -1.857030019420.984 11—
11succeeded -1.862232815019.7307 11—
12succeeded -1.860899512720.4211 11—
13succeeded -1.863771940220.5564 11—
14succeeded -1.866720043519.7779 11—
15succeeded -1.866996515420.6871 11—
16succeeded -1.849851081020.6563 11—
17succeeded -1.846622439921.1899 11—
18succeeded -1.854822757220.3215 11—
19succeeded -1.840321079920.2137 11—