mirror of
https://github.com/QuantumPackage/qp2.git
synced 2024-11-16 02:53:51 +01:00
67 lines
1.4 KiB
Groff
67 lines
1.4 KiB
Groff
.\" Man page generated from reStructuredText.
|
|
.
|
|
.TH "QP_RESET" "1" "Jun 15, 2019" "2.0" "Quantum Package"
|
|
.SH NAME
|
|
qp_reset \- | Quantum Package >
|
|
.
|
|
.nr rst2man-indent-level 0
|
|
.
|
|
.de1 rstReportMargin
|
|
\\$1 \\n[an-margin]
|
|
level \\n[rst2man-indent-level]
|
|
level margin: \\n[rst2man-indent\\n[rst2man-indent-level]]
|
|
-
|
|
\\n[rst2man-indent0]
|
|
\\n[rst2man-indent1]
|
|
\\n[rst2man-indent2]
|
|
..
|
|
.de1 INDENT
|
|
.\" .rstReportMargin pre:
|
|
. RS \\$1
|
|
. nr rst2man-indent\\n[rst2man-indent-level] \\n[an-margin]
|
|
. nr rst2man-indent-level +1
|
|
.\" .rstReportMargin post:
|
|
..
|
|
.de UNINDENT
|
|
. RE
|
|
.\" indent \\n[an-margin]
|
|
.\" old: \\n[rst2man-indent\\n[rst2man-indent-level]]
|
|
.nr rst2man-indent-level -1
|
|
.\" new: \\n[rst2man-indent\\n[rst2man-indent-level]]
|
|
.in \\n[rst2man-indent\\n[rst2man-indent-level]]u
|
|
..
|
|
.sp
|
|
This command resets parts of the \fI\%EZFIO\fP directory.
|
|
.SH USAGE
|
|
.INDENT 0.0
|
|
.INDENT 3.5
|
|
.sp
|
|
.nf
|
|
.ft C
|
|
qp_reset [\-adhm] EZFIO_DIR
|
|
.ft P
|
|
.fi
|
|
.UNINDENT
|
|
.UNINDENT
|
|
.INDENT 0.0
|
|
.TP
|
|
.B \-a, \-\-all
|
|
Reset to the state in which the directory is after after running qp_create_ezfio\&.
|
|
.UNINDENT
|
|
.INDENT 0.0
|
|
.TP
|
|
.B \-d, \-\-dets
|
|
Deletes the determinants and CI coefficients.
|
|
.UNINDENT
|
|
.INDENT 0.0
|
|
.TP
|
|
.B \-m, \-\-mos
|
|
Deletes the MOs, and consequently the determinants and CI coefficients.
|
|
.UNINDENT
|
|
.SH AUTHOR
|
|
A. Scemama, E. Giner
|
|
.SH COPYRIGHT
|
|
2019, A. Scemama, E. Giner
|
|
.\" Generated by docutils manpage writer.
|
|
.
|