编程语言libraryC++

psi4

Name: psi4
Rating: 5 (1165 reviews)
Author: psi4

Open-Source Quantum Chemistry – an electronic structure package in C++ driven by Python

1,165 stars492 forks444 issuesLGPL-3.0更新于 2026/4/21

c-plus-pluschemistrycomputational-chemistryphysicspythonquantum-chemistry

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