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physics.comp-ph2026
Towards stable and accurate electron dynamics via neural network based time-dependent variational Monte Carlo
Weizhong Fu, Zhe Li, Yubing Qian +3
Real-time dynamics of interacting electrons lies at the interface between quantum mechanics and non-equilibrium physics, governing the microscopic origin of ultrafast phenomena of…
physics.comp-ph2024
Enhancing GPU-acceleration in the Python-based Simulations of Chemistry Framework
Xiaojie Wu, Qiming Sun, Zhichen Pu +11
We describe our contribution as industrial stakeholders to the existing open-source GPU4PySCF project (https: //github.com/pyscf/gpu4pyscf), a GPU-accelerated Python quantum chemis…
physics.comp-ph2024
Emergent Wigner phases in moiré superlattice from deep learning
Xiang Li, Yubing Qian, Weiluo Ren +2
Moiré superlattice designed in stacked van der Waals material provides a dynamic platform for hosting exotic and emergent condensed matter phenomena. However, the relevance of str…