Re: Reg: error in log file

From: Jim Phillips (jim_at_ks.uiuc.edu)
Date: Thu Oct 30 2014 - 10:46:01 CDT

Those are not errors, just normal reports on the interpolation tables.
If the reported inconsistency was large this would indicate a bug, but at
this level it's just discretization error from comparing two adjacent
energy values in the table to the energy gradient in the table.

Jim

On Wed, 22 Oct 2014, Akshay Bhatnagar wrote:

> Hello
>
> i am getting some errors in my log file like:
>
> INCONSISTENCY IN FAST TABLE ENERGY VS FORCE: 0.000325096 AT 11.9556
>
>
> INCONSISTENCY IN SCOR TABLE ENERGY VS FORCE: 0.000324844 AT 11.9556
>
> INCONSISTENCY IN VDWA TABLE ENERGY VS FORCE: 0.0040507 AT 0.251946
>
> INCONSISTENCY IN VDWB TABLE ENERGY VS FORCE: 0.00150189 AT 0.251946
>
>
> Can anyone clarify the actual meaning of these statements?. is my
> installation wrong or the coordinate file?.
>
> Thank you for the concern
>
>
> With Regards
> Akshay Bhatnagar
> PhD Student
> BITS Pilani Hyderabad Campus
>

This archive was generated by hypermail 2.1.6 : Thu Dec 31 2015 - 23:21:19 CST