Conversion between different data file formats: Difference between revisions
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awk -f xyz2inpcrd input.xyz outpur.inpcrd |
awk -f xyz2inpcrd input.xyz outpur.inpcrd |
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Revision as of 13:48, 30 April 2008
xyz -> inpcrd
prepare file xyz2inpcrd containing the following line:
{printf("%.7f %.7f %.7f "), $1, $2, $3} {getline} {printf("%.7f %.7f %.7f\n"), $1, $2, $3}
next type
awk -f xyz2inpcrd input.xyz outpur.inpcrd