The CASINO forum

Thank you and Mike very much.

Regards,
Rajesh

Dear CASINO developers, I am getting following errors during installation of CASINO's new latest beta version v2.13.802-1-g198d8d47 into laptop. make[2]: *** No rule to make target '/home/.../CASINO/utils/plot_expval/constants.f90', needed by '/home/rajesh/CASINO/utils/plot_expval/../zlib/linuxpc-gn...

Thank you sir for your kind support.

Thank you for your reply. The energies are bouncing about by rather more than the statistical error bars on the individual VMC calculations, but that is not unexpected since there is noise due to the reoptimisation of the parameters. Please give me some idea how to avoid the noise due to reoptimizat...

Hi CASINO User,
Please give me some suggestions.

Thanks and regards,
Rajesh Sharma

Hi Vinod, Add following line into your Head Scrip of casino. -pe mpich &NPROC& e.g. #-! SCRIPT_HEAD: #-! #!/bin/bash #-! #$ -N &SCRIPT& #-! #$ -pe mpich &NPROC& #-! #$ -cwd #-! #$ -S /bin/bash #-! #$ -e &OUT& #-! #$ -o &OUT& #-! export PATH="&ENV.PATH...

Dear CASINO users, I am optimizing the pairing trial wave function for symmetric electron-hole bilayer at rs=5 d=1 a.u.. I have used the Gaussian pairing orbital and constrain the parameters so that they correspond to the Gaussian expansion of an exponential (sec. 7.4.8 of manual) in which case Rex ...

Dear Sir, Thank you for your reply. Is it possible that some other issue on your computer caused the job to halt? I have been looking for it, I feel like this issue may be related to Ubuntu 16.04/gfortran5.4.0 since I have tried to run the same jobs on the other PC with the same configurations as me...

How do you know that it stops before the end?

I have set the opt_cycles = 100 , but before it finish all cycles stopped at 5th cycle as you can see in the OUT file. And This happened many times.

Hi Katharina

Here I have attached the input and out put file for electron-hole bilayer.
Thank
Rajesh