[QE-users] a problem with spline_ps = true

Paolo Giannozzi paolo.giannozzi at uniud.it
Fri Jan 17 14:13:17 CET 2025


On 1/17/25 13:51, Magdalena Grochowska wrote:

> Hi!
> 
> I am new to Quantum Espresso, and I wanted to run some basic NMR 
> calculations using GIPAW. I have QE xersion 7.3.1, and GIPAW seemed to 
> have been installed properly (?)
> However, when I try to run any of the examples provided in GIPAW folder 
> (let's say quartz, so the command I use is pw.x -i quartz-scf.in 
> <http://quartz-scf.in>), I encounter the following error:
> 
>   Error in routine  read_namelists (1):
>        bad line in namelist &system: "    spline_ps = .true." (error 
> could be in the previous line) 
> 
> Do you know what the problem might be?

variable "spline_ps" does not exist any longer

Paolo


> 
> kind regards,
> Magda Grochowska-Tatarczak
> 
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-- 
Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche,
Univ. Udine, via delle Scienze 206, 33100 Udine Italy, +39-0432-558216



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