.\" Man page generated from reStructuredText. . .TH "QP_EDIT" "1" "Jan 14, 2019" "2.0" "Quantum Package" .SH NAME qp_edit \- | 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 reads the content of the \fI\%EZFIO\fP directory and creates a temporary file containing the data. The data is presented as a \fIReStructured Text\fP (rst) document, where each section corresponds to the corresponding \fIQuantum Package\fP module. The content of the file can be modified to change the input parameters. When the text editor is closed, the updated data is saved into the \fI\%EZFIO\fP directory. .sp \fBNOTE:\fP .INDENT 0.0 .INDENT 3.5 The text editor which will be opened is defined by the \fBEDITOR\fP environment variable. .UNINDENT .UNINDENT .sp \fBWARNING:\fP .INDENT 0.0 .INDENT 3.5 When the wave function is too large (more than 10 000 determinants), the determinants are not displayed. .UNINDENT .UNINDENT .SH USAGE .INDENT 0.0 .INDENT 3.5 .sp .nf .ft C qp_edit [FLAGS] Flags : [\-c] [\-ndet int] [\-state int] [\-help] .ft P .fi .UNINDENT .UNINDENT .INDENT 0.0 .TP .B \-c Checks the input data .UNINDENT .INDENT 0.0 .TP .B \-ndet Truncates the wavefunction to the target number of determinants .UNINDENT .INDENT 0.0 .TP .B \-state Pick the target state as a new wavefunction. .UNINDENT .INDENT 0.0 .TP .B \-help Print the help text and exits .UNINDENT .sp Here is a short list of important control parameters : .INDENT 0.0 .TP .B read_wf If \fBfalse\fP, initialize the calculation with a single\-determinant wave function. If \fBtrue\fP, initialize the calculation with the wave function stored in the \fI\%EZFIO\fP directory. .UNINDENT .SH AUTHOR A. Scemama, E. Giner .SH COPYRIGHT 2018, A. Scemama, E. Giner .\" Generated by docutils manpage writer. .