Jean-Philip Piquemal @piquemal@mastodon-pa.sorbonne-universite.fr

Join me today at the @nvidia #GTC23. I will present some our group join efforts with @qubit_pharma to develop the HYPERION QC simulator: "How Short-Term Hybrid #HPC-#quantumcomputing can Accelerate #drugdiscovery" [S51584], Mar 22 3:00 PM CET #compchem https://www.nvidia.com/gtc/session-catalog/?tab.catalogallsessionstab=16566177511100015Kus&search=piquemal#/session/1666624617519001WoIw

#compchem #quantumcomputing Just out @ WIRES Comp Mol Sci and #OpenAccess : Open source variational quantum eigensolver extension of the quantum learning machine for quantum chemistry. Great work by M. Haidar & nice collab. with M. J. Rančić, Y. Maday https://doi.org/10.1002/wcms.1664

#compchem #quantumcomputing Good read: Grid-based methods for chemistry simulations on a quantum computer http://dx.doi.org/10.1126/sciadv.abo7484

#compchem #quantumcomputing Good read: Reference-State Error Mitigation: A Strategy for High Accuracy Quantum Computation of Chemistry https://doi.org/10.1021/acs.jctc.2c00807

#compchem #quantumcomputing New #preprint: Overlap-ADAPT-VQE: Practical Quantum Chemistry on Quantum Computers via Overlap-Guided Compact Ansätze. Great work by C. Feniou and M. Hassan; nice theochem/maths interdisciplinary collaboration with Y. Maday. https://doi.org/10.48550/arXiv.2301.10196

#compchem #quantumcomputing New #preprint: Extension of the Trotterized Unitary Coupled Cluster to Triple Excitations. Nice work by @HaidarM54481494@twitter.com
https://doi.org/10.48550/arXiv.2212.12462

#compchem Finally out @PhysRevA@twitter.com: Calculating the ground-state energy of benzene under spatial deformations with noisy #quantumcomputing. This work with W. Sennane & M. Rančić aimed to estimate the feasibility of using the UCC ansatz on near-term devices. https://doi.org/10.1103/PhysRevA.107.012416

We have an open position for a a senior researcher in #quantumcomputing for #compchem @qubit_pharma@twitter.com. https://qubitpharmaceuticals.teamtailor.com/jobs/2265349-senior-researcher-in-quantum-computing

#quantumcomputing Good read: Pioneering quantum information science https://doi.org/10.1038/s43588-022-00368-0

#quantumcomputing Good read: Challenges and opportunities in quantum machine learning https://doi.org/10.1038/s43588-022-00311-3

#compchem #quantumcomputing Good read: Perspective on the Current State-of-the-Art of Quantum Computing for Drug Discovery Applications https://doi.org/10.1021/acs.jctc.2c00574

#compchem #QuantumComputing Good read: Localized Quantum Chemistry on Quantum Computers. https://doi.org/10.1021/acs.jctc.2c00388

#compchem #quantumcomputing Good read: Dual exponential coupled cluster theory: Unitary adaptation, implementation in the variational quantum eigensolver framework and pilot applications. https://doi.org/10.1063/5.0114688

I did not introduce myself after setling up in #Mastodon. I am Professor of Chemistry at Sorbonne Université in Paris. Technically, I am a quantum chemist but I learned a while back ago that molecules do move over time...(incredible!). I am therefore interested in Multiscale Quantum Chemistry and Molecular Simulation. My group's research is performed in strong interdisciplinary interactions with Applied #Maths & #HPC.
#compchem #supercomputing #quantumcomputing #machinelearning