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Could other potential functions be added into RASPA2? like the ReaxFF potential function. #32

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tjugonghao opened this issue Dec 27, 2021 · 1 comment

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@tjugonghao
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Sometimes, it is found that chemical asdorption behaviors calculated by the potential functions in the RASPA are not accurate, could other potential functions be added into RASPA2, like the ReaxFF potential function.

Thanks

@mamadahmadii
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hi
I used the raspa guides and instal the program, but when I want to run the raspa examples for testing the program I received this error: "command not found"
In below I mentioned the code that I used:

simulate simulation.input

I really appreciate any help you can provide
Best regard

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