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.\" DO NOT MODIFY THIS FILE! It was generated by help2man 1.47.4.
.TH ASE-GUI "1" "October 2016" "ase-gui 3.12.0" "User Commands"
.SH NAME
ase-gui \- graphical user interface for ASE
.SH SYNOPSIS
.B ase-gui
[\fI\,options\/\fR] [\fI\,file\/\fR[\fI\,, file2, \/\fR...]]
.SH DESCRIPTION
See the online manual (https://wiki.fysik.dtu.dk/ase/ase/gui/gui.html) for
more information.
.SH OPTIONS
.TP
\fB\-\-version\fR
show program's version number and exit
.TP
\fB\-h\fR, \fB\-\-help\fR
show this help message and exit
.TP
\fB\-n\fR NUMBER, \fB\-\-image\-number\fR=\fI\,NUMBER\/\fR
Pick image(s) from trajectory. NUMBER can be a single
number (use a negative number to count from the back)
or a range: start:stop:step, where the ":step" part
can be left out \- default values are 0:nimages:1.
.TP
\fB\-u\fR I, \fB\-\-show\-unit\-cell\fR=\fI\,I\/\fR
0: Don't show unit cell. 1: Show unit cell. 2: Show
all of unit cell.
.TP
\fB\-r\fR REPEAT, \fB\-\-repeat\fR=\fI\,REPEAT\/\fR
Repeat unit cell. Use "\-r 2" or "\-r 2,3,1".
.TP
\fB\-R\fR ROTATIONS, \fB\-\-rotations\fR=\fI\,ROTATIONS\/\fR
Examples: "\-R \fB\-90x\fR", "\-R 90z,\-30x".
.TP
\fB\-o\fR FILE, \fB\-\-output\fR=\fI\,FILE\/\fR
Write configurations to FILE.
.TP
\fB\-g\fR EXPR, \fB\-\-graph\fR=\fI\,EXPR\/\fR
Plot x,y1,y2,... graph from configurations or write
data to sdtout in terminal mode. Use the symbols: i,
s, d, fmax, e, ekin, A, R, E and F. See
https://wiki.fysik.dtu.dk/ase/ase/gui/gui.html
#plotting\-data for more details.
.TP
\fB\-t\fR, \fB\-\-terminal\fR
Run in terminal window \- no GUI.
.TP
\fB\-\-aneb\fR
Read ANEB data.
.TP
\fB\-\-interpolate\fR=\fI\,N\/\fR
Interpolate N images between 2 given images.
.TP
\fB\-b\fR, \fB\-\-bonds\fR
Draw bonds between atoms.
.TP
\fB\-s\fR FLOAT, \fB\-\-scale\fR=\fI\,FLOAT\/\fR
Scale covalent radii.
.TP
\fB\-v\fR, \fB\-\-verbose\fR
Verbose mode.
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