ABINIT Discussion Forums

hello everyone, I have compiled before however i tried to do a gw calculation and i got an error that said it was due to compilation so I decided to recompile. However, whenever i issue the command make mj4 after a successful configuration i get the same error every time. I have changed versions of ...

this is the error code when insert -debug. Help please. --> fermi energy found automatic Traceback (most recent call last): File "AbinitBandStructureMaker.py", line 836, in <module> datasetkey[-1].append(float(starter[i].split()[1])) ValueError: could not convert string to float: =

I'm having trouble plotting the band structure in the fold2Bloch tutorial with the scripts provided. I have Matlab and scilab. In Matlab i got nothing, Scilab gave me a plot but it made no sense. i also tried python AbinitBandstructuremaker.py and got an error saying datasetkey[-1].append(float(star...