Publications
Excited State-Specific CASSCF Theory for the Torsion of Ethylene
Journal of Chemical Theory and Computation
(2024)
20
5105
(doi: 10.1021/acs.jctc.4c00212)
Spin coupling is all you need: Encoding strong electron correlation in molecules on quantum computers
(2024)
(doi: 10.48550/arxiv.2404.18878)
Can $GW$ Handle Multireference Systems?
Journal of Chemical Physics
(2024)
(doi: 10.48550/arxiv.2401.03745)
Can GW handle multireference systems?
Journal of Chemical Physics
(2024)
160
114101
(doi: 10.1063/5.0196561)
Rationale for the extrapolation procedure in selected configuration interaction.
The Journal of chemical physics
(2024)
160
104102
(doi: 10.1063/5.0192458)
Excited state-specific CASSCF theory for the torsion of ethylene
(2024)
(doi: 10.48550/arxiv.2402.13046)
Spin-coupled molecular orbitals: chemical intuition meets quantum chemistry
(2024)
(doi: 10.48550/arxiv.2402.08858)
Rationale for the Extrapolation Procedure in Selected Configuration Interaction
(2023)
(doi: 10.48550/arxiv.2312.12530)
Accurate and gate-efficient quantum ansätze for electronic states without adaptive optimisation
(2023)
(doi: 10.48550/arxiv.2312.09761)
Exact electronic states with shallow quantum circuits from global optimisation
npj Quantum Information
(2023)
9
75
(doi: 10.1038/s41534-023-00744-2)
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