[SOLVED] missing rprim from output
Posted: Fri Jul 06, 2012 6:03 pm
Hello:
Is there a reason that ABINIT would ever not print the values of the rprim variable at the end of a calculation in the log/out file? This has been happening to me recently, but it never occured before. I am wondering if means that rprim are the default values, but it seems that ABINIT usually prints the value of the input variables even when they are default.
I need the rprim values to initialize other calculations. For example, after running a job with ionmov = 2 and optcell = 0, running a job with optcell /= 0.
Thank you,
Kale
Is there a reason that ABINIT would ever not print the values of the rprim variable at the end of a calculation in the log/out file? This has been happening to me recently, but it never occured before. I am wondering if means that rprim are the default values, but it seems that ABINIT usually prints the value of the input variables even when they are default.
I need the rprim values to initialize other calculations. For example, after running a job with ionmov = 2 and optcell = 0, running a job with optcell /= 0.
Thank you,
Kale