Hi All<div><br></div><div>I had installed the cp2k-7.1 and cp2k-8.2(GPU version). Then I wanted to test their calculation speed. The result is cp2k-8.2 > cp2k-7.1 > cp2k-8.2(with GPU).I was confused that the GPU could not accelerate calculation.</div><div><br></div><div>Could anybody give me some advice?</div><div>The input and output files are attached.</div><div><br></div><div>Yanyan</div><div><br></div><div><img alt="cp2k_test.png" data-iml="998458.8999999762" width="534px" height="371px" src="cid:f72fb50c-a96e-4d1c-a7a9-266011a0f119"><br></div>
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