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wave-packet

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Quantum simulation framework in Python: time-dependent Schrödinger and Gross–Pitaevskii equations in 1D/2D/3D with split-step Fourier (orders 2 and 4), rotating frames and vortex lattices, eigensolvers, optional CUDA GPU acceleration, and animated 3D rendering, all validated against analytic results.

  • Updated Oct 24, 2026
  • Python

Time-dependent quantum dynamics of H₂ on metal surfaces in six dimensions (Z, r, x, y, θ, φ): split-operator + FFT/DVR grids, S-matrix and state-to-state reaction/scattering probabilities. Modern C++20 port of SPO-DVR, CPU (OpenMP) and GPU (CUDA).

  • Updated Nov 14, 2026
  • C++

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