Benchmark test cases for DFT program or VASP?

Vasp transition state theory tools

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Alford
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Benchmark test cases for DFT program or VASP?

Post by Alford »

I am trying to build my workflow of using DFT to predict properties of some materials, but I am not sure if I do it all right, so I think there might be some benchmark test cases for the DFT program, but it seems there are only some test cases for testing if the installation is right. I am not looking for a database of material properties, but a complete test case that includes every step of how to build the model.
My question is:
where should I find a benchmark test case of my workflow?
And if it is not possible to get a benchmark test case for all DFT programs, a test case just for VASP would be also helpful.
graeme
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Re: Benchmark test cases for DFT program or VASP?

Post by graeme »

In the recent versions of vasp, you can find a testsuite provided.
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