tbase1.in error

Total energy, geometry optimization, DFT+U, spin....

Moderator: bguster

Locked
bcramer
Posts: 1
Joined: Wed Mar 20, 2013 6:44 pm

tbase1.in error

Post by bcramer » Wed Mar 20, 2013 7:03 pm

Hi,
I installed abinit v.7 [/b]for the first time. No error during ./configure and make process. OS: OpenSuse 12.1 32b
Environment settings:
----------------------------------------------------------------------
PATH=$PATH:/usr/local/abinit-7.0.5/src/98_main
export PATH
----------------------------------------------------------------------
I am using the first two files from /usr/local/abinit-7.0.5/tests/tutorial/Input: tbase1.in and tbase.2.in, tbase1_x. and tbase2_x.files
I changed the two first lines of tbase1_x and the elimination of one "../" in the last line.
Running abinit I get the following message (for both, tbase1 and tbase2:

isfile.F90:90:ERROR
Checks for existence of file ../tbase2_1.in
but INQUIRE finds file does not exist. Action : check file name and re-run.
ABINIT

Give name for formatted input file:
../tbase2_1.in
Give name for formatted output file:
tbase2_2.out
Give root name for generic input files:
tbase2_xi
Give root name for generic output files:
tbase2_xo
Give root name for generic temporary files:
tbase2_x

isfile.F90:90:ERROR
Checks for existence of file ../tbase2_1.in
but INQUIRE finds file does not exist. Action : check file name and re-run.
"log2" 82L, 2528C
**********************
Any help will be wellcome
Regards
Bruno

User avatar
jzwanzig
Posts: 504
Joined: Mon Aug 17, 2009 9:25 am

Re: tbase1.in error

Post by jzwanzig » Sat Mar 23, 2013 11:46 am

Well, as the error message says, it is trying to find file tbase_1.in at location "..", that is, one directory above the current working directory. Is that file at the location? Typically, the input file to abinit (the file of file names) looks like:

gs.in
gs.out
gsi
gso
gs
pseudo_file_1
pseudo_file_2
....

where gs.in is the input file, and exists in the current working directory.
Josef W. Zwanziger
Professor, Department of Chemistry
Canada Research Chair in NMR Studies of Materials
Dalhousie University
Halifax, NS B3H 4J3 Canada
jzwanzig@gmail.com

Locked