most citedThe Python Simulations of Chemistry Framework: 10 years of an open-source quantum chemistry project

4 citations · 4 across the 4 of their papers we have counts for

collaborators

7 papers

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…

cond-mat.str-el2026

Topological invariant of periodic many body wavefunction from charge pumping simulation

Haoxiang Chen, Yubing Qian, Weiluo Ren +2

Many-body topological quantum states host exotic quantum phenomena and lie at the forefront of developing next-generation quantum technologies. Recently emerged neural network wave…

physics.chem-ph20264 cited

The Python Simulations of Chemistry Framework: 10 years of an open-source quantum chemistry project

Qiming Sun, Matthew R Hermes, Xiaojie Wu +100

Over the past decade, the Python-based Simulations of Chemistry Framework (PySCF) has developed into a widely used open-source platform for electronic structure theory and quantum…

physics.chem-ph2026

Permutation invariant multi-scale full quantum neural network wavefunction

Pengzhen Cai, Yubing Qian, Li Deng +8

Solving the intricate quantum behavior of interacting particles is key to unlocking the mysteries of condensed matter, but capturing their complex correlations across different sca…

cond-mat.str-el2024

Taming Landau level mixing in fractional quantum Hall states with deep learning

Yubing Qian, Tongzhou Zhao, Jianxiao Zhang +3

Strong correlation brings a rich array of emergent phenomena, as well as a daunting challenge to theoretical physics study. In condensed matter physics, the fractional quantum Hall…

physics.chem-ph2024

Deep learning quantum Monte Carlo for solids

Yubing Qian, Xiang Li, Zhe Li +2

Deep learning has deeply changed the paradigms of many research fields. At the heart of chemical and physical sciences is the accurate ab initio calculation of many-body wavefuncti…