Lv4
478 积分 2025-10-24 加入
High-performance GPU-accelerated evaluation of electron repulsion integrals
1天前
已完结
High-Performance, High-Angular-Momentum J Engine on Graphics Processing Units
5天前
已完结
Alexander V. Nemukhin: early advocate for natural bonding and resonance conceptions of chemical bonding
10天前
已完结
Calculating Water Thermodynamics in the Binding Site of Proteins – Applications of WaterMap to Drug Discovery
12天前
已完结
Memory-Efficient Recursive Evaluation of 3-Center Gaussian Integrals
1个月前
已完结
Distributed memory, GPU accelerated Fock construction for hybrid, Gaussian basis density functional theory
1个月前
已完结
High-Performance Evaluation of High Angular Momentum 4-Center Gaussian Integrals on Modern Accelerated Processors
1个月前
已完结
3-center and 4-center 2-particle Gaussian AO integrals on modern accelerated processors
1个月前
已完结
Relativistic effects on the magnetic shielding in solids: First-principles computation in a plane wave code
1个月前
已完结
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