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benchmarks/QS_mp2_rpa/32: fix included file name

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shoshijak 2020-03-11 10:41:52 +01:00 • committed by Alfio Lazzaro
parent 51a2e8eac2
commit d4fd0e2e2a
1 changed files with 4 additions and 4 deletions
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8
benchmarks/QS_mp2_rpa/32-H2O/RI-RPA.inp
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@ -1,7 +1,7 @@
#CPQA INCLUDE ./H2O-32.xyz
#CPQA INCLUDE ./BASIS_H2O
#CPQA INCLUDE ./H2O-32-PBE-TZ.inp
#CPQA INCLUDE ./H2O-32-RI-RPA-TZ.inp
#CPQA INCLUDE ./H2O-32-RI-dRPA-TZ.inp
&GLOBAL
PROJECT RI-RPA
PROGRAM FARMING
@ -22,17 +22,17 @@
# calculate RI-RPA correlation energy (three times)
&JOB
DIRECTORY .
INPUT_FILE_NAME H2O-32-RI-RPA-TZ.inp
INPUT_FILE_NAME H2O-32-RI-dRPA-TZ.inp
OUTPUT_FILE_NAME result.log
&END JOB
&JOB
DIRECTORY .
INPUT_FILE_NAME H2O-32-RI-RPA-TZ.inp
INPUT_FILE_NAME H2O-32-RI-dRPA-TZ.inp
OUTPUT_FILE_NAME result.log
&END JOB
&JOB
DIRECTORY .
INPUT_FILE_NAME H2O-32-RI-RPA-TZ.inp
INPUT_FILE_NAME H2O-32-RI-dRPA-TZ.inp
OUTPUT_FILE_NAME result.log
&END JOB
&END FARMING