Operation Guide 4.1 Program Startup Configure the Python environment (ensure the dependent libraries are installed and the C extension modules are compiled successfully); Use a Python IDE (such as ...
O_ lennard-jones 53.0 3.30 // P. Bai, M. Tsapatsis, J. I. Siepmann, J. Phys. Chem. C 2013, 117, 24375-24387. Si_ lennard-Jones 22.0 2.30 // idem Al_ lennard-Jones 22.0 2.30 // Taken the same as Si. He ...
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