Muhammad Bilal Ahmed Siddique | Shandong University

Muhammad Bilal Ahmed Siddique

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I did some DFT calculations with Gaussian 16 by using mix basis set and I forgot to create a checkpoint file .chk. Is there any way to create ?

I did some DFT calculations with Gaussian 16 by using mix basis set and I forgot to create a checkpoint file .chk. Is there any way to create ?

15 March 2023 4,827 5 View