—We present a framework for parallel divide-and-conquer algorithms that separates the performance contributions of algorithmic structure from those of the underlying runtime. The framework implements true recursive parallel decomposition via rayon::join() at every recursion level—explicitly contrasted with wrapper approaches that delegate to opaque library routines—and introduces hardware-aware threshold selection for Intel’s hybrid P-core/E-core architecture. We formalize algorithm behavior using the work-span model and derive closed-form expressions for the serial fraction that governs scalability. On the i7-13650HX (6 P-cores + 8 E-cores), parallel merge sort achieves 6.35× speedup at 1M elements, while Amdahl’s-law analysis attributes the 39% efficiency ceiling at 14 cores to a 13% inherently sequential merge fraction—a structural bottleneck distinct from runtime overhead. Thread affinity experiments show P-core-only placement outperforms all-core Operating Systems ( OS ) scheduling by 14% for quicksort. Honest benchmarking against Rust’s standard library, Rayon, ndarray, and Intel Math Kernel Library (MKL) confirms that production libraries achieve 3–30× superior throughput through combined pdqsort, Single Instruction Multiple Data (SIMD), and Basic Linear Algebra Subprograms (BLAS) optimizations, while our framework isolates individual optimization layers for research. The complete framework is released as open-source software under the Massachusetts Institute of Technology (MIT) license to support reproducible research.
Tetsurou Kizaki, D. C. Bogatinoska, Amita Nandal et al.· Journal of Advances in Infor...· 0 citations
The (ABX₃) perovskites form the basis of the future of optoelectronics, but the limiting DFT calculations remain the bottleneck to high-throughput density screening. Our presented explainable machine learning (ML) framework, based on SHapley Additive exPlanations (SHAP), attains a mean absolute error (MAE) of 0.2644 eV in predicting band gaps and revealing physics-consistent drivers (lattice volume and coordination). Combining SHAP-informed feature engineering with gradient-boosted trees with validation on Materials Project (MP) data (that includes locating stable and novel candidates) will bridge the gap between accuracy and interpretability. Compared to literature results of Broad Learning Systems, interpretable GBRT + symbolic regression, attention-based networks, and Conv2D-SVM (Fourier descriptors), our framework is chemically useful, reproducible, and balanced with high interpretability. We report positive demonstration of inverse design of high confidence ABX3 candidates with 1.5–2.5 eV separations, such as the sub-optimized discovery of RbSnS3, which provides a scalable way towards rational discovery of perovskites. Uncertainty quantification through quantile regression and conformal prediction allows the framework to flag out-of-domain predictions automatically, as demonstrated by the NaAlF₃ case.
Aldrin Manon, Rajiv Kumar Gill, vijay kumar et al.· International Journal of Com...· 0 citations
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