Re: [SIESTA-L] (urgent) warning: XV file not found

2009-05-28 Thread tim evans
Dear Dr. Postnikov and Ravi, thanks for your reply. It is odd, I have already followed what you mentioned in your emails 1. same systemlabel 2. same folder 3. not preceding by a false XV using command Still I receive the warning below is my input: SystemNameGaNPSS SystemLabel

Re: [SIESTA-L] (urgent) warning: XV file not found

2009-05-28 Thread Ravi Agrawal
Hi Tim, There are two things, which I suggest you check: (i) you actually have the XV file in the same folder where you are running the job; (ii) the filename should match the System Label (for e.g. if you XV file is abc.XV; then your system label should be abc) Hope this helps, Ravi On Thu, May

Re: [SIESTA-L] (urgent) warning: XV file not found

2009-05-28 Thread apostnik
> Hi, > > I have relaxed the structure and I have revised the .fdf file with the > relaxed results to start other calculations and I have switched > "UseSaveData" to .true. but I receive the warning that XV file not found. > It > also occurs when I use "MD.UseSaveXV". > > Please guide me how I shou

[SIESTA-L] (urgent) warning: XV file not found

2009-05-28 Thread tim evans
Hi, I have relaxed the structure and I have revised the .fdf file with the relaxed results to start other calculations and I have switched "UseSaveData" to .true. but I receive the warning that XV file not found. It also occurs when I use "MD.UseSaveXV". Please guide me how I should arrange the i