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PySCF

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Software:30581
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swMATH18750MaRDI QIDQ30581FDOQ30581


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Cited In (8)

  • Quantum simulation of the ground-state Stark effect in small molecules: a case study using IBM Q
  • Discontinuous Galerkin method with Voronoi partitioning for quantum simulation of chemistry
  • Explicitly antisymmetrized neural network layers for variational Monte Carlo simulation
  • A Fast Iterative Algorithm for Near-Diagonal Eigenvalue Problems
  • Comparison of Accuracy and Scalability of Gauss--Newton and Alternating Least Squares for CANDECOMC/PARAFAC Decomposition
  • Approximating Matrix Eigenvalues by Subspace Iteration with Repeated Random Sparsification
  • Convergence analysis of adaptive DIIS algorithms with application to electronic ground state calculations
  • Solving many-electron Schrödinger equation using deep neural networks


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