Supporting code for "Autoregressive neural-network wavefunctions for ab initio quantum chemistry".
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Updated
Jun 17, 2022 - Python
Supporting code for "Autoregressive neural-network wavefunctions for ab initio quantum chemistry".
Neural Network Quantum State
Supporting code for "Systematic improvement of neural network quantum states using Lanczos (NeurIPS 2022)""
Group work for Solid State physics course at Aalto University
NNQS for the Klein--Gordon--Fock equation
This notebook implements a program that uses the NNQS method to find the ground and first excited states of an infinite square potential well. The program penalizes the wave function when it extends beyond the boundaries of the well, and good agreement with theoretical predictions has been achieved.
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