The CASINO forum

Hi Shamil, The CASINO code is mainly used for electronic structure calculations. Although there is a way to include other particles besides electrons using the "PARTICLES" keyword, it seems like that's not what you are looking for. If you could post what systems you wanted to look at and w...

I suppose since no one is biting, I will.

I think you may be able to temporarily fix this by changing line 697 of "install" which says:
change this to:
Let me know if this works.

Vladimir, Thanks for the feedback. Using autopep8 https://pypi.python.org/pypi/autopep8 I formatted to the pep8 conventions. Using pep257 https://pypi.python.org/pypi/pep257 I formatted to the pep257 conventions. I believe it should be good now, but I would appreciate any recommendations. Thank you,...

Dr. Drummond and Dr. Towler, Thanks for your quick replies. You've both given me a lot of insight on how to implement this, and I'll get started on it. I don't foresee any major issues (but who does?) I'd be extremely happy if the graphing was implemented into CASINO provided its not a hassle. Let m...

Hi all, Let me preface this with a warning: I am a first year graduate student working with QMC so if I ask a stupid question that can be easily answered with some reading please direct me towards the resources! First, I wanted to draw some attention to a python alternative to the graphdmc utility. ...