the Piquemal Group
@piquemalgroup.bsky.social
Theoretical Chemistry research group @lct-umr7616.bsky.social, Sorbonne Université & CNRS| Led by Prof. Piquemal (@jppiquem.bsky.social)|
#compchem #HPC #MachineLearning #quantumcomputing
Website: https://piquemalresearch.com
#compchem #HPC #MachineLearning #quantumcomputing
Website: https://piquemalresearch.com
Reposted by the Piquemal Group
The paper is #openaccess. You can also check the related blog @qubit-pharma.bsky.social :
blog.qubit-pharmaceuticals.com/blog/unlocki...
blog.qubit-pharmaceuticals.com/blog/unlocki...
October 5, 2025 at 6:14 AM
The paper is #openaccess. You can also check the related blog @qubit-pharma.bsky.social :
blog.qubit-pharmaceuticals.com/blog/unlocki...
blog.qubit-pharmaceuticals.com/blog/unlocki...
Reposted by the Piquemal Group
A molecule-adaptive, non-uniform grid approach for first-quantized quantum chemistry enables efficient resolution of electron-nuclear cusps and eliminates Coulomb singularities, allowing accurate ground-state simulations on quantum hardware.
@jppiquem.bsky.social
arxiv.org/abs/2507.20583
@jppiquem.bsky.social
arxiv.org/abs/2507.20583
Real-Space Chemistry on Quantum Computers: A Fault-Tolerant Algorithm with Adaptive Grids and Transcorrelated Extension
First-quantized, real-space formulations of quantum chemistry on quantum computers are appealing: qubit count scales logarithmically with spatial resolution, and Coulomb operators achieve quadratic in...
arxiv.org
July 29, 2025 at 3:03 PM
A molecule-adaptive, non-uniform grid approach for first-quantized quantum chemistry enables efficient resolution of electron-nuclear cusps and eliminates Coulomb singularities, allowing accurate ground-state simulations on quantum hardware.
@jppiquem.bsky.social
arxiv.org/abs/2507.20583
@jppiquem.bsky.social
arxiv.org/abs/2507.20583