Quantum-Accelerators/quacc
quacc is a flexible platform for computational materials science and quantum chemistry that is built for the big data era.
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quacc is a flexible platform for computational materials science and quantum chemistry that is built for the big data era.
Fast, modern C++ DSP framework, FFT, Sample Rate Conversion, FIR/IIR/Biquad Filters (SSE, AVX, AVX-512, ARM NEON, RISC-V RVV)
atomate2 is a library of computational materials science workflows
DeePTB: A deep learning package for tight-binding Hamiltonian with ab initio accuracy.
That's all 4 repositories in this period.