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QE NEB v.6.5<br>
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Hello everyone,</div>
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I ran a NEB calculation and wanted to restart it with <br>
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restart_mode = 'restart'<br>
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CI_scheme='auto'</div>
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However, the calculation finishes immediately, and in the output I get</div>
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image energy (eV) error (eV/A) frozen
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<div> 1 -56444.8993322 0.000000 F</div>
<div> 2 -56444.6772938 0.000000 F</div>
<div> 3 -56443.4926550 0.000000 F</div>
<div> 4 -56444.9127763 0.000000 F</div>
<div> 5 -56445.3797990 0.000000 F</div>
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<div> climbing image = 3</div>
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All errors are zero, even though in 'prefix.path' the forces are clearly not zero.</div>
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What am I doing wrong?</div>
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Also, why is the first and last image not frozen anymore? Shouldn't they be kept fixed by default?</div>
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In a second test I used the output from 'prefix.crd' to restart the NEB manually (from_scratch) and it is running fine.<br>
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Best,</div>
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Paul<br>
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