- #I dont understand how to install gfortran generator
- #I dont understand how to install gfortran archive
I know that did not answer your original question, but I hope it solved the problem. It includes APE in the set of software it installs. I have a script that installs a whole bunch of popular quantum chemistry software (that I have been trying to circulate to save others the weeks it took me to get it all up and running):
The stuff you do not need is useful for installing other common quantum chemistry software anyway, and probably will not hurt to have around. I mention you might not need all of the stuff installed from apt-get, but I am pretty sure that covers it. You can just copy and paste them into terminal as long as you are running it as root-just type sudo su first and put in your password.) configure -prefix=/usr/local -with-libxc-prefix=/opt/etsf
#I dont understand how to install gfortran generator
I have installed a different pseudopotential generator called APE with the following set of commands:Īpt-get -y install libscalapack-mpi1 libscalapack-mpi-dev gfortran etsf-io libetsf-io-dev netcdf-bin libnetcdf-dev libsparskit-dev libsparskit2.0 libatlas-dev libatlas-base-dev gsl-bin libgsl0-dev libblas-dev liblapack-dev I know this is not an answer to your question, but it could be a solution to your problem nonetheless. Į) Verify that you can reproduce the results of the sample run given in This can beĭone by specifying the environment variable "FHIPP_PATH" which should pointįor a list of the shell scripts' options enter and. Download the OpenWhiskCLI-latest-mac-amd64.zip bundle instead, and run the wsk executable in there. Shell scripts "psgen" and "pswatch" (stored in. Install macOS 10.15 Catalina (Intel CPU) Download the OpenWhiskCLI-latest-mac-386.zip file from Unzip the file Run wsk Workaround. The present "Makefile" might be incompatible with your platform.Ĭorrections shoud be straightforward, however linking the objectsĭ) Set appropriate paths for executables and graphics header files etc.
If linking the library fails, the respective syntax for linking in
#I dont understand how to install gfortran archive
Alternatively go to "./lib" and create the archive (an excerpt of the LAPACK package put into "./lib").ī) If libFREE is used make should take automatically care of generating and You need to specify either use of the ESSL library or the libFREE library Some linear algebra package is required, and
You need to set compiler and linker flagsĬompatible to your platform. I'm trying to install the fhi98pp packag.Ī) Customize "Makefile" in "./src".
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