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  1. Energy-Optimization-of-Molecular-Structures Energy-Optimization-of-Molecular-Structures Public

    "This repository contains codes, input files, output data, and analyses related to the energy optimization of molecular structures using software such as Gaussian, Orca, PELE, and OPTIM."

    Python 1

  2. Computational-physics Computational-physics Public

    Advanced Computational Physics Methods

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