Hi,
Could any one please let me know what is the option
available in UNIX to print by specifying the paper size?
We are using Unix11i. I could n't see any option specified in the 'lp' command to print the report by specifying the size of the paper. It would be of great help to me, if... (1 Reply)
Hi,
I need a help regarding a small requirement. I have a list of C files. I need to put them in a file but without .c extension.
say if I have the files as file01.c, file02.c, file03.c etc
My file say cfiles should have
file01
file02
file03
...
...
etc
Appreciate your quick help on... (3 Replies)
I am currently scanning a directory with a shell script to look for all files with a .sh extension. I am wondering how to make it look for more then one extension. For example all .sh, .conf, and .sql files?
Currently this is what I am doing....
find... (3 Replies)
I'm trying to clean up my samba share and need to print the found file or print the path of the image it tried to searched for. So far I have this but can't seem to get the logic right. Can anyone help point me in the right direction?
for FILE in `cat list`; do
if ;
then
... (1 Reply)
Hello,
Sometimes i need to clear all the jobs of a print queue and it is really annoying to cancel one by one.
Is there a way to cancel all print jobs for a specific print queue with a single command instead of cancelling them one by one?
My AIX system is 5.3
Thank you for your attention (2 Replies)
Currently, I have a print filter that takes a text file, that convert it into PCL which then gets to a HP printer. This works.
Now I need to embedded a image file within the text file.
I'm able to convert the image file into PCL and I can cat both files together to into a single document... (1 Reply)
Guys, I have a issue that I am trying to rectify please advise.
lpstat -t shows
scheduler is running
printer lext644 disabled since Mon Dec 02 19:48:18 2013. available.I have restarted the printer service and it shows online but the above says disabled. I have a lot of jobs in the print... (1 Reply)
Hi All,
I want to fetch the files based on .done file and display the .csv files and Wil take .csv files for processing.
1.I need to display the .done files from the directory.
2.next i need to search for the .Csv files based on .done file.then move .csv files for the one directory
... (2 Replies)
Hi
I have a requirement like this:
/abc/a/x.txt
/abc/a/y.txt
/abc/b/x.gz
/abc/b/y.txt
I need output like this:
/abc/a:*.txt
/abc/b:*.txt
/abc/b:*.gz
I have tried find /abc -type f -name "*.*" ||awk -F . '{print $NF}' it is print only extensions without path name.
Please... (5 Replies)
Discussion started by: lijjumathew
5 Replies
LEARN ABOUT DEBIAN
geom
geom(1)geom(1)NAME
geom - analyzes a molecular geometry input in Cartesian coordinates.
DESCRIPTION
The program geom reads a set of Cartesian coordinates and determines from them the bond distances (Bohr and angstrom), bond angles, tor-
sional angles, out-of-plane angles (optional), moments of inertia, and rotational constants.
FILES REQUIRED
input.dat - Input file
and one of the following:
geom.dat - geometry file
file11.dat - PSI-format geometry/gradient file
FILES GENERATED
geom.out - file containing the analysis
INPUT OPTIONS
The geom program has the following options:
-h Print help information (these options).
-aces [filename]
Read the input in an ACES output format, with each line consisting of atomic symbol, atomic number, and Cartesian coordinates (in
Bohr). The optional argument is the name of the geometry input file, which defaults to geom.dat.
-qchem [filename]
Read the input in an QCHEM output format, with each line consisting of the atom number, the atomic symbol, and Cartesian coordinates
(in Angstroms). The optional argument is the name of the geometry input file, which defaults to geom.dat.
-xyz [filename]
Read the input in an XYZ output format. The first line contains the number of atoms and the second line is a comment line. Subse-
quent lines each contain the atomic symbol and Cartesian X Y and Z coordinates (in Angstroms). The optional argument is the name of
the geometry input file, which defaults to geom.dat.
-oop Print out-of-plane angles, where the angle a-b-c-d is defined as the angle formed by the vector a-d and the plane defined by atoms
b, c, and d.
DO_OOP = boolean
Same as command-line switch -oop described above.
ISOTOPES = matrix of reals/strings
Used to specify masses to be used in the calculation of the center of mass and rotational constants. One array is provided for each
isotopomer to be calculated. The arrays can mix floating point numbers with strings which designate isotopes. If this array is not
given and file11.dat is present, then the masses will be obtained by converting the atomic numbers in file11. If masses are not
given by ISOTOPES or by file11, then no mass-related quantities will be calculated.
-g [filename]
Read Cartesian coordinates from a file other than file11.dat. If a filename is not given, the default is geom.dat. The alternative
file is assumed to be in a format similar to that of PSI's geom.dat. Since such files do not contain atomic numbers, the moments of
inertia and rotational constants are not calculated if this option is used.
READ_GEOM = boolean
This option in input.dat tells geom to read the geometry from geom.dat in the PSI geom.dat format.
-a Print parameters for all pair distances.
PRINT_ALL_DIST = boolean
Same as -a flag described above.
-d distance
Only print parameters involving pairs of atoms which are less than distance bohr apart (default value is 4.0 bohr).
PRINT_DISTANCE = value
Same as -d flag described above.
-angstrom
The input coordinates are in angstroms, not bohr.
ANGSTROM = boolean
If TRUE, the input coordinates are in angstroms instead of bohr. The default is FALSE.
The following example is for calculating the geometrical information for water with several different isotopes. The geometry is
read from geom.dat rather than from file11.dat.
geom: (
read_geom = true
isotopes = (
(O H H)
(O D D)
(O18 1.007825 1.007825)
) )
5 June, 1998 geom(1)