
César Feniou
17 posts









#compchem 🚨Just out in J. Phys. Chem. Lett @JPhysChem 🚨and incoming Front Cover: 𝐒𝐩𝐚𝐫𝐬𝐞 𝐪𝐮𝐚𝐧𝐭𝐮𝐦 𝐬𝐭𝐚𝐭𝐞 𝐩𝐫𝐞𝐩𝐚𝐫𝐚𝐭𝐢𝐨𝐧 𝐟𝐨𝐫 𝐬𝐭𝐫𝐨𝐧𝐠𝐥𝐲 𝐜𝐨𝐫𝐫𝐞𝐥𝐚𝐭𝐞𝐝 𝐬𝐲𝐬𝐭𝐞𝐦𝐬. doi.org/10.1021/acs.jp… First peer-reviewed paper using our #GPU-accelerated Hyperion-1 quantum computer emulator. This work presents extensive 28 logical qubits simulations performed on a single @nvidia (8 X A100 GPU) #HPC node. We conducted quantum state preparation for complex molecular systems using various advanced methods that are evaluated and compared in terms of their circuit depth, CNOT count & classical computational complexity. Our simulations indicate that the recently developed Overlap-ADAPT-VQE algorithm (Commun Phys, 2023, 6, 192) offers the most advantageous performance for near-term applications. Congrats @ChemCesar @qubit_pharma! Nice collaboration with E. Giner @LCT_UMR7616. Supercomputer time @Genci_fr.



















