mirror of https://gitlab.com/QEF/q-e.git
236 lines
5.7 KiB
Tcl
236 lines
5.7 KiB
Tcl
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#
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# Help-file automatically created by helpdoc utility
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#
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# !!! DO NOT EDIT: CHANGES WILL BE LOST !!!
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#
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# ------------------------------------------------------------------------
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help fildrho -helpfmt helpdoc -helptext {
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<ul>
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<li> <em>Variable: </em><big><b>fildrho</b></big>
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</li>
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<br><li> <em>Type: </em>CHARACTER</li>
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<br><li> <em>Default: </em> ' '
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</li>
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<br><li> <em>Description:</em>
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</li>
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<blockquote><pre>
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The file containing the variation of the charge
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density at the q point under consideration, this
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file is produced by phonon.
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</pre></blockquote>
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</ul>
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}
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# ------------------------------------------------------------------------
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help fild0rho -helpfmt helpdoc -helptext {
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<ul>
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<li> <em>Variable: </em><big><b>fild0rho</b></big>
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</li>
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<br><li> <em>Type: </em>CHARACTER</li>
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<br><li> <em>Default: </em> ' '
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</li>
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<br><li> <em>Description:</em>
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</li>
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<blockquote><pre>
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The file containing the variation of the charge
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density at q=0, this file is produced by phonon.
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</pre></blockquote>
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</ul>
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}
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# ------------------------------------------------------------------------
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help amass -helpfmt helpdoc -helptext {
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<ul>
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<li> <em>Variables: </em><big><b>amass(i), i=1,ntyp</b></big>
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</li>
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<br><li> <em>Type: </em>CHARACTER</li>
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<br><li> <em>Description:</em>
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</li>
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<blockquote><pre>
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ionic masses [atomic mass units]
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</pre></blockquote>
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</ul>
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}
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# ------------------------------------------------------------------------
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help prefix -helpfmt helpdoc -helptext {
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<ul>
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<li> <em>Variable: </em><big><b>prefix</b></big>
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</li>
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<br><li> <em>Type: </em>CHARACTER</li>
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<br><li> <em>Default: </em> 'pwscf'
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</li>
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<br><li> <em>Description:</em>
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</li>
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<blockquote><pre> prefix for file names
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</pre></blockquote>
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</ul>
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}
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# ------------------------------------------------------------------------
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help outdir -helpfmt helpdoc -helptext {
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<ul>
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<li> <em>Variable: </em><big><b>outdir</b></big>
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</li>
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<br><li> <em>Type: </em>CHARACTER</li>
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<br><li> <em>Default: </em>
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value of the ESPRESSO_TMPDIR environment variable if set;
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current directory ('./') otherwise
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</li>
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<br><li> <em>Description:</em>
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</li>
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<blockquote><pre>
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Directory containing input, output, and scratch files;
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must be the same as specified in the calculation of
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the unperturbed system and for phonon calculation.
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</pre></blockquote>
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</ul>
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}
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# ------------------------------------------------------------------------
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help fildyn -helpfmt helpdoc -helptext {
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<ul>
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<li> <em>Variable: </em><big><b>fildyn</b></big>
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</li>
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<br><li> <em>Type: </em>CHARACTER</li>
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<br><li> <em>Default: </em> 'd3dyn'
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</li>
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<br><li> <em>Description:</em>
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</li>
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<blockquote><pre>
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The file where the derivative of the dynamical
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matrix will be written
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</pre></blockquote>
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</ul>
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}
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# ------------------------------------------------------------------------
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help ethr_ph -helpfmt helpdoc -helptext {
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<ul>
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<li> <em>Variable: </em><big><b>ethr_ph</b></big>
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</li>
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<br><li> <em>Type: </em>REAL</li>
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<br><li> <em>Default: </em> 1.0d-5
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</li>
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<br><li> <em>Description:</em>
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</li>
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<blockquote><pre>
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Threshold for iterative diagonalization
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(accuracy in ryd of the calculated eigenvalues).
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</pre></blockquote>
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</ul>
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}
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# ------------------------------------------------------------------------
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help q0mode_todo -helpfmt helpdoc -helptext {
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<ul>
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<li> <em>Variables: </em><big><b>q0mode_todo(i), i=1,3*nat</b></big>
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</li>
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<br><li> <em>Type: </em>INTEGER</li>
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<br><li> <em>Default: </em> 0
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</li>
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<br><li> <em>Status: </em> q0mode_todo is statically allocated to dimension 300
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</li>
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<br><li> <em>Description:</em>
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</li>
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<blockquote><pre>
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This array contains the list of the q=0 modes that
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will be computed. If q0mode_todo(1).eq.0 the
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program will compute every q=0 mode.
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</pre></blockquote>
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</ul>
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}
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# ------------------------------------------------------------------------
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help wraux -helpfmt helpdoc -helptext {
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<ul>
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<li> <em>Variable: </em><big><b>wraux</b></big>
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</li>
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<br><li> <em>Type: </em>LOGICAL</li>
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<br><li> <em>Default: </em> .false.
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</li>
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<br><li> <em>Description:</em>
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</li>
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<blockquote><pre>
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If .true. the program will write different terms
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of the matrix on different files.
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</pre></blockquote>
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</ul>
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}
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# ------------------------------------------------------------------------
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help recv -helpfmt helpdoc -helptext {
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<ul>
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<li> <em>Variable: </em><big><b>recv</b></big>
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</li>
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<br><li> <em>Type: </em>LOGICAL</li>
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<br><li> <em>Default: </em> .false.
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</li>
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<br><li> <em>Description:</em>
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</li>
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<blockquote><pre> Specify .true. for a recover run.
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</pre></blockquote>
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</ul>
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}
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# ------------------------------------------------------------------------
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help istop -helpfmt helpdoc -helptext {
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<ul>
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<li> <em>Variable: </em><big><b>istop</b></big>
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</li>
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<br><li> <em>Type: </em>INTEGER</li>
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<br><li> <em>Default: </em> 0
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</li>
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<br><li> <em>Description:</em>
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</li>
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<blockquote><pre>
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If this number is set different from zero the
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program will stop after the specified routine
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and will write the partial result in the recover
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file.
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</pre></blockquote>
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</ul>
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}
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# ------------------------------------------------------------------------
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help iverbosity -helpfmt helpdoc -helptext {
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<ul>
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<li> <em>Variable: </em><big><b>iverbosity</b></big>
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</li>
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<br><li> <em>Type: </em>INTEGER</li>
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<br><li> <em>Default: </em> 0
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</li>
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<br><li> <em>Description:</em>
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</li>
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<blockquote><pre> type of printing ( 0 few, 1 all )
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</pre></blockquote>
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</ul>
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}
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