Information for build libint2-2.6.0-1.ocs23
| ID | 14350 | ||||||||||||||||||||||||||
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| Package Name | libint2 | ||||||||||||||||||||||||||
| Version | 2.6.0 | ||||||||||||||||||||||||||
| Release | 1.ocs23 | ||||||||||||||||||||||||||
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| Source | git+https://gitee.com/opencloudos-stream/libint2.git?.#471e142866479a016707da41612c8dee175ffe22 | ||||||||||||||||||||||||||
| Summary | A library for efficient evaluation of electron repulsion integrals | ||||||||||||||||||||||||||
| Description | LIBINT computes the Coulomb and exchange integrals, which in electronic structure theory are called electron repulsion integrals (ERIs). This is by far the most common type of integrals in molecular structure theory. LIBINT uses recursive schemes that originate in seminal Obara-Saika method and Head-Gordon and Pople’s variation thereof. The idea of LIBINT is to optimize computer implementation of such methods by implementing an optimizing compiler to generate automatically highly-specialized code that runs well on super-scalar architectures. | ||||||||||||||||||||||||||
| Built by | bbrucezhang | ||||||||||||||||||||||||||
| State | complete | ||||||||||||||||||||||||||
| Volume | DEFAULT | ||||||||||||||||||||||||||
| Started | Wed, 07 Aug 2024 16:16:41 CST | ||||||||||||||||||||||||||
| Completed | Wed, 07 Aug 2024 17:12:01 CST | ||||||||||||||||||||||||||
| Task | build (dist-ocs23-epol9, /opencloudos-stream/libint2.git:.:origin/master) | ||||||||||||||||||||||||||
| Extra | {'source': {'original_url': 'git+https://gitee.com/opencloudos-stream/libint2.git?.#origin/master'}} | ||||||||||||||||||||||||||
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| Changelog | * Wed Jul 24 2024 OpenCloudOS Release Engineering <releng@opencloudos.tech> - 2.6.0-1 - initial build |
