Ab-initio quantum chemistry with neural-network wavefunctions

Ab-initio quantum chemistry with neural-network wavefunctions

26 August 2022

Antonio Mezzacapo

Giuseppe Carleo

Frank Noé

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Papers citing "Ab-initio quantum chemistry with neural-network wavefunctions"

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Quantum computing and artificial intelligence: status and perspectives Giovanni Acampora Andris Ambainis Natalia Ares Leonardo Banchi Pallavi Bhardwaj ... Markus Schmitt Philipp Slusallek Filippo Vicentini Christof Weitenberg Frank K. Wilhelm 52 1 0 29 May 2025
Operator Learning for Schrödinger Equation: Unitarity, Error Bounds, and Time Generalization Yash Patel Unique Subedi Ambuj Tewari 61 0 0 23 May 2025
Operator SVD with Neural Networks via Nested Low-Rank Approximation J. Jon Ryu Xiangxiang Xu H. Erol Yuheng Bu Lizhong Zheng G. Wornell 83 0 0 06 Feb 2024
Waveflow: Enforcing boundary conditions in smooth normalizing flows with application to fermionic wave functions Luca Thiede Chong Sun A. Aspuru‐Guzik 77 1 0 27 Nov 2022
First principles physics-informed neural network for quantum wavefunctions and eigenvalue surfaces M. Mattheakis G. R. Schleder Daniel T. Larson E. Kaxiras 50 3 0 08 Nov 2022