2022-09-28 18:04:21 +02:00
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<?xml version="1.0" encoding="utf-8"?>
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<!DOCTYPE html PUBLIC "-//W3C//DTD XHTML 1.0 Strict//EN"
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"http://www.w3.org/TR/xhtml1/DTD/xhtml1-strict.dtd">
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<html xmlns="http://www.w3.org/1999/xhtml" lang="en" xml:lang="en">
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<head>
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2022-12-09 11:14:08 +01:00
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<!-- 2022-12-09 Fri 10:13 -->
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2022-09-28 18:04:21 +02:00
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<meta name="viewport" content="width=device-width, initial-scale=1" />
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<title>Point</title>
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<meta name="generator" content="Org mode" />
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<meta name="author" content="TREX CoE" />
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<style type="text/css">
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/* pre.src-C++ doesn't work in CSS */
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pre.src-css:before { content: 'CSS'; }
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pre.src-D:before { content: 'D'; }
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pre.src-haskell:before { content: 'Haskell'; }
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pre.src-hledger:before { content: 'hledger'; }
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pre.src-java:before { content: 'Java'; }
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pre.src-latex:before { content: 'LaTeX'; }
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pre.src-lilypond:before { content: 'Lilypond'; }
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pre.src-lua:before { content: 'Lua'; }
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pre.src-matlab:before { content: 'MATLAB'; }
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pre.src-mscgen:before { content: 'Mscgen'; }
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pre.src-ocaml:before { content: 'Objective Caml'; }
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pre.src-octave:before { content: 'Octave'; }
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pre.src-org:before { content: 'Org mode'; }
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pre.src-oz:before { content: 'OZ'; }
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pre.src-plantuml:before { content: 'Plantuml'; }
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pre.src-processing:before { content: 'Processing.js'; }
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pre.src-python:before { content: 'Python'; }
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pre.src-R:before { content: 'R'; }
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pre.src-ruby:before { content: 'Ruby'; }
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pre.src-sass:before { content: 'Sass'; }
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pre.src-scheme:before { content: 'Scheme'; }
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pre.src-screen:before { content: 'Gnu Screen'; }
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pre.src-sed:before { content: 'Sed'; }
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pre.src-sh:before { content: 'shell'; }
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pre.src-sql:before { content: 'SQL'; }
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pre.src-sqlite:before { content: 'SQLite'; }
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/* additional languages in org.el's org-babel-load-languages alist */
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pre.src-forth:before { content: 'Forth'; }
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pre.src-io:before { content: 'IO'; }
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pre.src-J:before { content: 'J'; }
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pre.src-makefile:before { content: 'Makefile'; }
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pre.src-maxima:before { content: 'Maxima'; }
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pre.src-perl:before { content: 'Perl'; }
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pre.src-picolisp:before { content: 'Pico Lisp'; }
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pre.src-scala:before { content: 'Scala'; }
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pre.src-shell:before { content: 'Shell Script'; }
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pre.src-ebnf2ps:before { content: 'ebfn2ps'; }
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/* additional language identifiers per "defun org-babel-execute"
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in ob-*.el */
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pre.src-cpp:before { content: 'C++'; }
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pre.src-abc:before { content: 'ABC'; }
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pre.src-coq:before { content: 'Coq'; }
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pre.src-groovy:before { content: 'Groovy'; }
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/* additional language identifiers from org-babel-shell-names in
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ob-shell.el: ob-shell is the only babel language using a lambda to put
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the execution function name together. */
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pre.src-bash:before { content: 'bash'; }
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pre.src-csh:before { content: 'csh'; }
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pre.src-ash:before { content: 'ash'; }
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pre.src-dash:before { content: 'dash'; }
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pre.src-ksh:before { content: 'ksh'; }
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pre.src-mksh:before { content: 'mksh'; }
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pre.src-posh:before { content: 'posh'; }
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/* Additional Emacs modes also supported by the LaTeX listings package */
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pre.src-ada:before { content: 'Ada'; }
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pre.src-asm:before { content: 'Assembler'; }
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pre.src-caml:before { content: 'Caml'; }
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pre.src-delphi:before { content: 'Delphi'; }
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pre.src-html:before { content: 'HTML'; }
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pre.src-idl:before { content: 'IDL'; }
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pre.src-mercury:before { content: 'Mercury'; }
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pre.src-metapost:before { content: 'MetaPost'; }
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pre.src-modula-2:before { content: 'Modula-2'; }
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pre.src-pascal:before { content: 'Pascal'; }
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pre.src-ps:before { content: 'PostScript'; }
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pre.src-prolog:before { content: 'Prolog'; }
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pre.src-simula:before { content: 'Simula'; }
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pre.src-tcl:before { content: 'tcl'; }
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pre.src-tex:before { content: 'TeX'; }
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pre.src-plain-tex:before { content: 'Plain TeX'; }
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pre.src-verilog:before { content: 'Verilog'; }
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pre.src-vhdl:before { content: 'VHDL'; }
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pre.src-xml:before { content: 'XML'; }
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pre.src-nxml:before { content: 'XML'; }
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/* add a generic configuration mode; LaTeX export needs an additional
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(add-to-list 'org-latex-listings-langs '(conf " ")) in .emacs */
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pre.src-conf:before { content: 'Configuration File'; }
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table { border-collapse:collapse; }
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td, th { vertical-align:top; }
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th.org-right { text-align: center; }
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th.org-left { text-align: center; }
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th.org-center { text-align: center; }
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td.org-right { text-align: right; }
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td.org-left { text-align: left; }
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td.org-center { text-align: center; }
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dt { font-weight: bold; }
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.footpara { display: inline; }
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.footdef { margin-bottom: 1em; }
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.figure { padding: 1em; }
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.figure p { text-align: center; }
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2022-11-18 14:16:53 +01:00
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.equation-container {
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display: table;
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text-align: center;
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width: 100%;
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}
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.equation {
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vertical-align: middle;
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}
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.equation-label {
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display: table-cell;
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text-align: right;
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vertical-align: middle;
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}
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2022-09-28 18:04:21 +02:00
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.inlinetask {
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padding: 10px;
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border: 2px solid gray;
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margin: 10px;
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background: #ffffcc;
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}
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#org-div-home-and-up
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{ text-align: right; font-size: 70%; white-space: nowrap; }
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textarea { overflow-x: auto; }
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#org-info-js_console-label
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{ font-size: 10px; font-weight: bold; white-space: nowrap; }
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.org-info-js_search-highlight
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{ background-color: #ffff00; color: #000000; font-weight: bold; }
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.org-svg { width: 90%; }
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/*]]>*/-->
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</style>
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<link rel="stylesheet" title="Standard" href="qmckl.css" type="text/css" />
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<script type="text/javascript" src="org-info.js">
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/**
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*
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* @source: org-info.js
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*
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* @licstart The following is the entire license notice for the
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* JavaScript code in org-info.js.
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*
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2022-11-18 14:16:53 +01:00
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* Copyright (C) 2012-2020 Free Software Foundation, Inc.
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2022-09-28 18:04:21 +02:00
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*
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*
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* The JavaScript code in this tag is free software: you can
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* redistribute it and/or modify it under the terms of the GNU
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* General Public License (GNU GPL) as published by the Free Software
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* Foundation, either version 3 of the License, or (at your option)
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* any later version. The code is distributed WITHOUT ANY WARRANTY;
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* without even the implied warranty of MERCHANTABILITY or FITNESS
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* FOR A PARTICULAR PURPOSE. See the GNU GPL for more details.
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*
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* As additional permission under GNU GPL version 3 section 7, you
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* may distribute non-source (e.g., minimized or compacted) forms of
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* that code without the copy of the GNU GPL normally required by
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* section 4, provided you include this license notice and a URL
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* through which recipients can access the Corresponding Source.
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*
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* @licend The above is the entire license notice
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* for the JavaScript code in org-info.js.
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*
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*/
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</script>
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<script type="text/javascript">
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/*
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@licstart The following is the entire license notice for the
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JavaScript code in this tag.
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2022-11-18 14:16:53 +01:00
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Copyright (C) 2012-2020 Free Software Foundation, Inc.
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2022-09-28 18:04:21 +02:00
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The JavaScript code in this tag is free software: you can
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redistribute it and/or modify it under the terms of the GNU
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General Public License (GNU GPL) as published by the Free Software
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Foundation, either version 3 of the License, or (at your option)
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any later version. The code is distributed WITHOUT ANY WARRANTY;
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without even the implied warranty of MERCHANTABILITY or FITNESS
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FOR A PARTICULAR PURPOSE. See the GNU GPL for more details.
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As additional permission under GNU GPL version 3 section 7, you
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may distribute non-source (e.g., minimized or compacted) forms of
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that code without the copy of the GNU GPL normally required by
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section 4, provided you include this license notice and a URL
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through which recipients can access the Corresponding Source.
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@licend The above is the entire license notice
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for the JavaScript code in this tag.
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*/
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<!--/*--><![CDATA[/*><!--*/
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org_html_manager.set("TOC_DEPTH", "4");
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org_html_manager.set("LINK_HOME", "index.html");
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org_html_manager.set("LINK_UP", "");
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org_html_manager.set("LOCAL_TOC", "1");
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org_html_manager.set("VIEW_BUTTONS", "0");
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org_html_manager.set("MOUSE_HINT", "underline");
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org_html_manager.set("FIXED_TOC", "0");
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org_html_manager.set("TOC", "1");
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org_html_manager.set("VIEW", "info");
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org_html_manager.setup(); // activate after the parameters are set
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/*]]>*///-->
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</script>
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<script type="text/javascript">
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/*
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@licstart The following is the entire license notice for the
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JavaScript code in this tag.
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2022-11-18 14:16:53 +01:00
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Copyright (C) 2012-2020 Free Software Foundation, Inc.
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2022-09-28 18:04:21 +02:00
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The JavaScript code in this tag is free software: you can
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redistribute it and/or modify it under the terms of the GNU
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General Public License (GNU GPL) as published by the Free Software
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Foundation, either version 3 of the License, or (at your option)
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any later version. The code is distributed WITHOUT ANY WARRANTY;
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without even the implied warranty of MERCHANTABILITY or FITNESS
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FOR A PARTICULAR PURPOSE. See the GNU GPL for more details.
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As additional permission under GNU GPL version 3 section 7, you
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may distribute non-source (e.g., minimized or compacted) forms of
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that code without the copy of the GNU GPL normally required by
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section 4, provided you include this license notice and a URL
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through which recipients can access the Corresponding Source.
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@licend The above is the entire license notice
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for the JavaScript code in this tag.
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*/
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<!--/*--><![CDATA[/*><!--*/
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function CodeHighlightOn(elem, id)
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{
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var target = document.getElementById(id);
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if(null != target) {
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elem.cacheClassTarget = target.className;
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target.className = "code-highlighted";
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elem.className = "code-highlighted";
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}
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}
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function CodeHighlightOff(elem, id)
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{
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var target = document.getElementById(id);
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if(elem.cacheClassElem)
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elem.className = elem.cacheClassElem;
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if(elem.cacheClassTarget)
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target.className = elem.cacheClassTarget;
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}
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/*]]>*///-->
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</script>
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<script type="text/x-mathjax-config">
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MathJax.Hub.Config({
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displayAlign: "center",
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displayIndent: "0em",
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"HTML-CSS": { scale: 100,
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font: "TeX"},
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});
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</script>
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<script type="text/javascript"
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src="https://cdnjs.cloudflare.com/ajax/libs/mathjax/2.7.0/MathJax.js?config=TeX-AMS_HTML"></script>
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</head>
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<body>
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<div id="org-div-home-and-up">
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<a accesskey="h" href=""> UP </a>
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<a accesskey="H" href="index.html"> HOME </a>
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</div><div id="content">
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<h1 class="title">Point</h1>
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<div id="table-of-contents">
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<h2>Table of Contents</h2>
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<div id="text-table-of-contents">
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<ul>
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2022-12-09 11:14:08 +01:00
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<li><a href="#orgdba4c77">1. Context</a>
|
2022-09-28 18:04:21 +02:00
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<ul>
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2022-12-09 11:14:08 +01:00
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<li><a href="#orgd3be10e">1.1. Data structure</a></li>
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<li><a href="#org96775c2">1.2. Access functions</a>
|
2022-09-28 18:04:21 +02:00
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<ul>
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2022-12-09 11:14:08 +01:00
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<li><a href="#org92e2962">1.2.1. Number of points</a></li>
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<li><a href="#org8c3f46a">1.2.2. Point coordinates</a></li>
|
2022-09-28 18:04:21 +02:00
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</ul>
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</li>
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2022-12-09 11:14:08 +01:00
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<li><a href="#org3eda4e1">1.3. Initialization functions</a></li>
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<li><a href="#org8a85218">1.4. Test</a></li>
|
2022-09-28 18:04:21 +02:00
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</ul>
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</li>
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</ul>
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</div>
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</div>
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2022-12-09 11:14:08 +01:00
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<div id="outline-container-orgdba4c77" class="outline-2">
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<h2 id="orgdba4c77"><span class="section-number-2">1</span> Context</h2>
|
2022-09-28 18:04:21 +02:00
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<div class="outline-text-2" id="text-1">
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<p>
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The following data stored in the context:
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</p>
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<table border="2" cellspacing="0" cellpadding="6" rules="groups" frame="hsides">
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<colgroup>
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<col class="org-left" />
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<col class="org-left" />
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<col class="org-left" />
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</colgroup>
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<thead>
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<tr>
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<th scope="col" class="org-left">Variable</th>
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<th scope="col" class="org-left">Type</th>
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<th scope="col" class="org-left">Description</th>
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</tr>
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</thead>
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<tbody>
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<tr>
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<td class="org-left"><code>num</code></td>
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<td class="org-left"><code>int64_t</code></td>
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<td class="org-left">Total number of points</td>
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</tr>
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<tr>
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<td class="org-left"><code>date</code></td>
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<td class="org-left"><code>uint64_t</code></td>
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<td class="org-left">Last modification date of the coordinates</td>
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</tr>
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<tr>
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<td class="org-left"><code>coord</code></td>
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<td class="org-left"><code>qmckl_matrix</code></td>
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<td class="org-left"><code>num</code> × 3 matrix</td>
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</tr>
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</tbody>
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</table>
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<p>
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We consider that the matrix is stored 'transposed' and 'normal'
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corresponds to the 3 × <code>num</code> matrix.
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</p>
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</div>
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2022-12-09 11:14:08 +01:00
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<div id="outline-container-orgd3be10e" class="outline-3">
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<h3 id="orgd3be10e"><span class="section-number-3">1.1</span> Data structure</h3>
|
2022-09-28 18:04:21 +02:00
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<div class="outline-text-3" id="text-1-1">
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<div class="org-src-container">
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<pre class="src src-c"><span style="color: #a020f0;">typedef</span> <span style="color: #a020f0;">struct</span> <span style="color: #228b22;">qmckl_point_struct</span> {
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<span style="color: #228b22;">int64_t</span> <span style="color: #a0522d;">num</span>;
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<span style="color: #228b22;">uint64_t</span> <span style="color: #a0522d;">date</span>;
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<span style="color: #228b22;">qmckl_matrix</span> <span style="color: #a0522d;">coord</span>;
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} <span style="color: #228b22;">qmckl_point_struct</span>;
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</pre>
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</div>
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<div class="org-src-container">
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<pre class="src src-c"><span style="color: #228b22;">qmckl_exit_code</span> <span style="color: #0000ff;">qmckl_init_point</span>(<span style="color: #228b22;">qmckl_context</span> <span style="color: #a0522d;">context</span>);
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</pre>
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</div>
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<div class="org-src-container">
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<pre class="src src-c"><span style="color: #228b22;">qmckl_exit_code</span> <span style="color: #0000ff;">qmckl_init_point</span>(<span style="color: #228b22;">qmckl_context</span> <span style="color: #a0522d;">context</span>) {
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<span style="color: #a020f0;">if</span> (qmckl_context_check(context) == QMCKL_NULL_CONTEXT) {
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|
<span style="color: #a020f0;">return</span> <span style="color: #008b8b;">false</span>;
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}
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|
<span style="color: #228b22;">qmckl_context_struct</span>* <span style="color: #a020f0;">const</span> <span style="color: #a0522d;">ctx</span> = (<span style="color: #228b22;">qmckl_context_struct</span>*) context;
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|
assert (ctx != <span style="color: #008b8b;">NULL</span>);
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memset(&(ctx->point), 0, <span style="color: #a020f0;">sizeof</span>(qmckl_point_struct));
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<span style="color: #a020f0;">return</span> QMCKL_SUCCESS;
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}
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</pre>
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</div>
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</div>
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</div>
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|
2022-12-09 11:14:08 +01:00
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<div id="outline-container-org96775c2" class="outline-3">
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<h3 id="org96775c2"><span class="section-number-3">1.2</span> Access functions</h3>
|
2022-09-28 18:04:21 +02:00
|
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<div class="outline-text-3" id="text-1-2">
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<p>
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Access functions return <code>QMCKL_SUCCESS</code> when the data has been
|
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|
successfully retrieved. They return <code>QMCKL_INVALID_CONTEXT</code> when
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|
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the context is not a valid context. If the function returns
|
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|
|
successfully, the variable pointed by the pointer given in argument
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|
contains the requested data. Otherwise, this variable is untouched.
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</p>
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</div>
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|
2022-12-09 11:14:08 +01:00
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<div id="outline-container-org92e2962" class="outline-4">
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<h4 id="org92e2962"><span class="section-number-4">1.2.1</span> Number of points</h4>
|
2022-09-28 18:04:21 +02:00
|
|
|
<div class="outline-text-4" id="text-1-2-1">
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<p>
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Returns the number of points stored in the context.
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</p>
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<div class="org-src-container">
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<pre class="src src-f90"><span style="color: #a020f0;">interface</span>
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<span style="color: #228b22;">integer</span>(<span style="color: #008b8b;">c_int32_t</span>) <span style="color: #a020f0;">function</span> <span style="color: #0000ff;">qmckl_get_point_num</span>(context, num) <span style="color: #a020f0;">bind</span>(C)
|
|
|
|
<span style="color: #a020f0;">use</span>, <span style="color: #a020f0;">intrinsic</span> :: <span style="color: #0000ff;">iso_c_binding</span>
|
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|
<span style="color: #a020f0;">import</span>
|
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|
<span style="color: #a020f0;">implicit</span> <span style="color: #228b22;">none</span>
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<span style="color: #228b22;">integer</span> (<span style="color: #008b8b;">c_int64_t</span>) , <span style="color: #a020f0;">intent</span>(in) , <span style="color: #a020f0;">value</span> ::<span style="color: #a0522d;"> context</span>
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|
<span style="color: #228b22;">integer</span> (<span style="color: #008b8b;">c_int64_t</span>) , <span style="color: #a020f0;">intent</span>(out) ::<span style="color: #a0522d;"> num</span>
|
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|
<span style="color: #a020f0;">end function</span>
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|
<span style="color: #a020f0;">end interface</span>
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</pre>
|
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</div>
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|
</div>
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</div>
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|
2022-12-09 11:14:08 +01:00
|
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<div id="outline-container-org8c3f46a" class="outline-4">
|
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|
|
<h4 id="org8c3f46a"><span class="section-number-4">1.2.2</span> Point coordinates</h4>
|
2022-09-28 18:04:21 +02:00
|
|
|
<div class="outline-text-4" id="text-1-2-2">
|
|
|
|
<p>
|
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|
|
Returns the point coordinates as sequences of (x,y,z).
|
|
|
|
The pointer is assumed to point on a memory block of size
|
|
|
|
<code>size_max</code> ≥ <code>3 * point_num</code>.
|
|
|
|
</p>
|
|
|
|
|
|
|
|
<div class="org-src-container">
|
|
|
|
<pre class="src src-f90"><span style="color: #a020f0;">interface</span>
|
|
|
|
<span style="color: #228b22;">integer</span>(<span style="color: #008b8b;">c_int32_t</span>) <span style="color: #a020f0;">function</span> <span style="color: #0000ff;">qmckl_get_point</span>(context, transp, coord, size_max) <span style="color: #a020f0;">bind</span>(C)
|
|
|
|
<span style="color: #a020f0;">use</span>, <span style="color: #a020f0;">intrinsic</span> :: <span style="color: #0000ff;">iso_c_binding</span>
|
|
|
|
<span style="color: #a020f0;">import</span>
|
|
|
|
<span style="color: #a020f0;">implicit</span> <span style="color: #228b22;">none</span>
|
|
|
|
|
|
|
|
<span style="color: #228b22;">integer</span> (<span style="color: #008b8b;">c_int64_t</span>) , <span style="color: #a020f0;">intent</span>(in) , <span style="color: #a020f0;">value</span> ::<span style="color: #a0522d;"> context</span>
|
|
|
|
<span style="color: #228b22;">character</span>(<span style="color: #008b8b;">c_char</span>) , <span style="color: #a020f0;">intent</span>(in) , <span style="color: #a020f0;">value</span> ::<span style="color: #a0522d;"> transp</span>
|
|
|
|
<span style="color: #228b22;">real</span> (<span style="color: #008b8b;">c_double</span> ) , <span style="color: #a020f0;">intent</span>(out) ::<span style="color: #a0522d;"> coord(*)</span>
|
|
|
|
<span style="color: #228b22;">integer</span> (<span style="color: #008b8b;">c_int64_t</span>) , <span style="color: #a020f0;">intent</span>(in) ::<span style="color: #a0522d;"> size_max</span>
|
|
|
|
<span style="color: #a020f0;">end function</span>
|
|
|
|
<span style="color: #a020f0;">end interface</span>
|
|
|
|
</pre>
|
|
|
|
</div>
|
|
|
|
</div>
|
|
|
|
</div>
|
|
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|
</div>
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|
2022-12-09 11:14:08 +01:00
|
|
|
<div id="outline-container-org3eda4e1" class="outline-3">
|
|
|
|
<h3 id="org3eda4e1"><span class="section-number-3">1.3</span> Initialization functions</h3>
|
2022-09-28 18:04:21 +02:00
|
|
|
<div class="outline-text-3" id="text-1-3">
|
|
|
|
<p>
|
|
|
|
When the data is set in the context, if the arrays are large
|
|
|
|
enough, we overwrite the data contained in them.
|
|
|
|
</p>
|
|
|
|
|
|
|
|
<p>
|
|
|
|
To set the data relative to the points in the context, one of the
|
|
|
|
following functions need to be called. Here, <code>num</code> is the number of
|
|
|
|
points to set.
|
|
|
|
</p>
|
|
|
|
|
|
|
|
<div class="org-src-container">
|
|
|
|
<pre class="src src-c"><span style="color: #228b22;">qmckl_exit_code</span> <span style="color: #0000ff;">qmckl_set_point</span> (<span style="color: #228b22;">qmckl_context</span> <span style="color: #a0522d;">context</span>,
|
|
|
|
<span style="color: #a020f0;">const</span> <span style="color: #228b22;">char</span> <span style="color: #a0522d;">transp</span>,
|
|
|
|
<span style="color: #a020f0;">const</span> <span style="color: #228b22;">int64_t</span> <span style="color: #a0522d;">num</span>,
|
|
|
|
<span style="color: #a020f0;">const</span> <span style="color: #228b22;">double</span>* <span style="color: #a0522d;">coord</span>,
|
|
|
|
<span style="color: #a020f0;">const</span> <span style="color: #228b22;">int64_t</span> <span style="color: #a0522d;">size_max</span>);
|
|
|
|
</pre>
|
|
|
|
</div>
|
|
|
|
|
|
|
|
<p>
|
|
|
|
Copy a sequence of <code>num</code> points \((x,y,z)\) into the context.
|
|
|
|
</p>
|
|
|
|
|
|
|
|
<div class="org-src-container">
|
|
|
|
<pre class="src src-c"><span style="color: #228b22;">qmckl_exit_code</span>
|
|
|
|
<span style="color: #0000ff;">qmckl_set_point</span> (<span style="color: #228b22;">qmckl_context</span> <span style="color: #a0522d;">context</span>,
|
|
|
|
<span style="color: #a020f0;">const</span> <span style="color: #228b22;">char</span> <span style="color: #a0522d;">transp</span>,
|
|
|
|
<span style="color: #a020f0;">const</span> <span style="color: #228b22;">int64_t</span> <span style="color: #a0522d;">num</span>,
|
|
|
|
<span style="color: #a020f0;">const</span> <span style="color: #228b22;">double</span>* <span style="color: #a0522d;">coord</span>,
|
|
|
|
<span style="color: #a020f0;">const</span> <span style="color: #228b22;">int64_t</span> <span style="color: #a0522d;">size_max</span>)
|
|
|
|
{
|
|
|
|
|
|
|
|
<span style="color: #a020f0;">if</span> (qmckl_context_check(context) == QMCKL_NULL_CONTEXT) {
|
|
|
|
<span style="color: #a020f0;">return</span> QMCKL_NULL_CONTEXT;
|
|
|
|
}
|
|
|
|
|
2022-11-18 14:16:53 +01:00
|
|
|
<span style="color: #a020f0;">if</span> (num <= 0) {
|
|
|
|
<span style="color: #a020f0;">return</span> qmckl_failwith( context,
|
2022-11-24 16:23:16 +01:00
|
|
|
QMCKL_INVALID_ARG_3,
|
2022-11-18 14:16:53 +01:00
|
|
|
<span style="color: #8b2252;">"qmckl_set_point"</span>,
|
|
|
|
<span style="color: #8b2252;">"Number of points should be >0."</span>);
|
|
|
|
}
|
|
|
|
|
2022-09-28 18:04:21 +02:00
|
|
|
<span style="color: #a020f0;">if</span> (size_max < 3*num) {
|
|
|
|
<span style="color: #a020f0;">return</span> qmckl_failwith( context,
|
|
|
|
QMCKL_INVALID_ARG_4,
|
|
|
|
<span style="color: #8b2252;">"qmckl_set_point"</span>,
|
|
|
|
<span style="color: #8b2252;">"Array too small"</span>);
|
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|
}
|
|
|
|
|
|
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|
<span style="color: #a020f0;">if</span> (transp != <span style="color: #8b2252;">'N'</span> && transp != <span style="color: #8b2252;">'T'</span>) {
|
|
|
|
<span style="color: #a020f0;">return</span> qmckl_failwith( context,
|
|
|
|
QMCKL_INVALID_ARG_2,
|
|
|
|
<span style="color: #8b2252;">"qmckl_set_point"</span>,
|
|
|
|
<span style="color: #8b2252;">"transp should be 'N' or 'T'"</span>);
|
|
|
|
}
|
|
|
|
|
|
|
|
<span style="color: #a020f0;">if</span> (coord == <span style="color: #008b8b;">NULL</span>) {
|
|
|
|
<span style="color: #a020f0;">return</span> qmckl_failwith( context,
|
|
|
|
QMCKL_INVALID_ARG_3,
|
|
|
|
<span style="color: #8b2252;">"qmckl_set_point"</span>,
|
|
|
|
<span style="color: #8b2252;">"coord is a NULL pointer"</span>);
|
|
|
|
}
|
|
|
|
|
|
|
|
<span style="color: #228b22;">qmckl_context_struct</span>* <span style="color: #a020f0;">const</span> <span style="color: #a0522d;">ctx</span> = (<span style="color: #228b22;">qmckl_context_struct</span>*) context;
|
|
|
|
assert (ctx != <span style="color: #008b8b;">NULL</span>);
|
|
|
|
|
|
|
|
<span style="color: #228b22;">qmckl_exit_code</span> <span style="color: #a0522d;">rc</span>;
|
|
|
|
<span style="color: #a020f0;">if</span> (num != ctx->point.num) {
|
|
|
|
|
|
|
|
<span style="color: #a020f0;">if</span> (ctx->point.coord.data != <span style="color: #008b8b;">NULL</span>) {
|
|
|
|
rc = qmckl_matrix_free(context, &(ctx->point.coord));
|
|
|
|
assert (rc == QMCKL_SUCCESS);
|
|
|
|
}
|
|
|
|
|
|
|
|
ctx->point.coord = qmckl_matrix_alloc(context, num, 3);
|
|
|
|
<span style="color: #a020f0;">if</span> (ctx->point.coord.data == <span style="color: #008b8b;">NULL</span>) {
|
|
|
|
<span style="color: #a020f0;">return</span> qmckl_failwith( context,
|
|
|
|
QMCKL_ALLOCATION_FAILED,
|
|
|
|
<span style="color: #8b2252;">"qmckl_set_point"</span>,
|
|
|
|
<span style="color: #008b8b;">NULL</span>);
|
|
|
|
}
|
|
|
|
};
|
|
|
|
|
|
|
|
ctx->point.num = num;
|
|
|
|
|
|
|
|
<span style="color: #a020f0;">if</span> (transp == <span style="color: #8b2252;">'T'</span>) {
|
|
|
|
<span style="color: #228b22;">double</span> *<span style="color: #a0522d;">a</span> = ctx->point.coord.data;
|
|
|
|
<span style="color: #483d8b;">#ifdef</span> HAVE_OPENMP
|
|
|
|
<span style="color: #483d8b;"> #pragma</span> omp <span style="color: #a020f0;">for</span>
|
|
|
|
<span style="color: #483d8b;">#endif</span>
|
|
|
|
<span style="color: #a020f0;">for</span> (<span style="color: #228b22;">int64_t</span> <span style="color: #a0522d;">i</span>=0 ; i<3*num ; ++i) {
|
|
|
|
a[i] = coord[i];
|
|
|
|
}
|
|
|
|
} <span style="color: #a020f0;">else</span> {
|
|
|
|
<span style="color: #483d8b;">#ifdef</span> HAVE_OPENMP
|
|
|
|
<span style="color: #483d8b;"> #pragma</span> omp <span style="color: #a020f0;">for</span>
|
|
|
|
<span style="color: #483d8b;">#endif</span>
|
|
|
|
<span style="color: #a020f0;">for</span> (<span style="color: #228b22;">int64_t</span> <span style="color: #a0522d;">i</span>=0 ; i<num ; ++i) {
|
|
|
|
qmckl_mat(ctx->point.coord, i, 0) = coord[3*i ];
|
|
|
|
qmckl_mat(ctx->point.coord, i, 1) = coord[3*i+1];
|
|
|
|
qmckl_mat(ctx->point.coord, i, 2) = coord[3*i+2];
|
|
|
|
}
|
|
|
|
}
|
|
|
|
|
2022-11-18 14:16:53 +01:00
|
|
|
/* <span style="color: #b22222;">Increment the date of the context</span> */
|
2022-09-28 18:04:21 +02:00
|
|
|
rc = qmckl_context_touch(context);
|
|
|
|
assert (rc == QMCKL_SUCCESS);
|
|
|
|
|
|
|
|
<span style="color: #a020f0;">return</span> QMCKL_SUCCESS;
|
|
|
|
|
|
|
|
}
|
|
|
|
</pre>
|
|
|
|
</div>
|
|
|
|
|
|
|
|
<div class="org-src-container">
|
|
|
|
<pre class="src src-f90"><span style="color: #a020f0;">interface</span>
|
|
|
|
<span style="color: #228b22;">integer</span>(<span style="color: #008b8b;">c_int32_t</span>)<span style="color: #a0522d;"> function qmckl_set_point(context, </span><span style="color: #a020f0;">&</span>
|
|
|
|
transp, num, coord, size_max) <span style="color: #a020f0;">bind</span>(C)
|
|
|
|
<span style="color: #a020f0;">use</span>, <span style="color: #a020f0;">intrinsic</span> :: <span style="color: #0000ff;">iso_c_binding</span>
|
|
|
|
<span style="color: #a020f0;">import</span>
|
|
|
|
<span style="color: #a020f0;">implicit</span> <span style="color: #228b22;">none</span>
|
|
|
|
|
|
|
|
<span style="color: #228b22;">integer</span> (<span style="color: #008b8b;">c_int64_t</span>) , <span style="color: #a020f0;">intent</span>(in) , <span style="color: #a020f0;">value</span> ::<span style="color: #a0522d;"> context</span>
|
|
|
|
<span style="color: #228b22;">character</span>(<span style="color: #008b8b;">c_char</span>) , <span style="color: #a020f0;">intent</span>(in) , <span style="color: #a020f0;">value</span> ::<span style="color: #a0522d;"> transp</span>
|
|
|
|
<span style="color: #228b22;">integer</span> (<span style="color: #008b8b;">c_int64_t</span>) , <span style="color: #a020f0;">intent</span>(in) , <span style="color: #a020f0;">value</span> ::<span style="color: #a0522d;"> num</span>
|
|
|
|
<span style="color: #228b22;">real</span> (<span style="color: #008b8b;">c_double</span> ) , <span style="color: #a020f0;">intent</span>(in) ::<span style="color: #a0522d;"> coord(*)</span>
|
|
|
|
<span style="color: #228b22;">integer</span> (<span style="color: #008b8b;">c_int64_t</span>) , <span style="color: #a020f0;">intent</span>(in) , <span style="color: #a020f0;">value</span> ::<span style="color: #a0522d;"> size_max</span>
|
|
|
|
<span style="color: #a020f0;">end function</span>
|
|
|
|
<span style="color: #a020f0;">end interface</span>
|
|
|
|
</pre>
|
|
|
|
</div>
|
|
|
|
</div>
|
|
|
|
</div>
|
|
|
|
|
|
|
|
|
2022-12-09 11:14:08 +01:00
|
|
|
<div id="outline-container-org8a85218" class="outline-3">
|
|
|
|
<h3 id="org8a85218"><span class="section-number-3">1.4</span> Test</h3>
|
2022-09-28 18:04:21 +02:00
|
|
|
<div class="outline-text-3" id="text-1-4">
|
|
|
|
<div class="org-src-container">
|
2022-11-18 14:16:53 +01:00
|
|
|
<pre class="src src-c">/* <span style="color: #b22222;">Reference input data</span> */
|
2022-09-28 18:04:21 +02:00
|
|
|
<span style="color: #228b22;">int64_t</span> <span style="color: #a0522d;">point_num</span> = chbrclf_elec_num;
|
|
|
|
<span style="color: #a020f0;">const</span> <span style="color: #228b22;">double</span>* <span style="color: #a0522d;">coord</span> = &(chbrclf_elec_coord[0][0][0]);
|
|
|
|
|
2022-11-18 14:16:53 +01:00
|
|
|
/* <span style="color: #b22222;">---</span> */
|
2022-09-28 18:04:21 +02:00
|
|
|
|
|
|
|
<span style="color: #228b22;">qmckl_exit_code</span> <span style="color: #a0522d;">rc</span>;
|
|
|
|
<span style="color: #228b22;">double</span> <span style="color: #a0522d;">coord2</span>[point_num*3];
|
|
|
|
<span style="color: #228b22;">double</span> <span style="color: #a0522d;">coord3</span>[point_num*3];
|
|
|
|
|
|
|
|
|
|
|
|
rc = qmckl_get_point (context, <span style="color: #8b2252;">'N'</span>, coord2, (point_num*3));
|
|
|
|
<span style="color: #0000ff;">assert</span>(rc == QMCKL_NOT_PROVIDED);
|
|
|
|
|
|
|
|
rc = qmckl_set_point (context, <span style="color: #8b2252;">'N'</span>, point_num, coord, (point_num*3));
|
|
|
|
<span style="color: #0000ff;">assert</span>(rc == QMCKL_SUCCESS);
|
|
|
|
|
|
|
|
<span style="color: #228b22;">int64_t</span> <span style="color: #a0522d;">n</span>;
|
|
|
|
rc = qmckl_get_point_num (context, &n);
|
|
|
|
<span style="color: #0000ff;">assert</span>(rc == QMCKL_SUCCESS);
|
|
|
|
<span style="color: #0000ff;">assert</span>(n == point_num);
|
|
|
|
|
|
|
|
rc = qmckl_get_point (context, <span style="color: #8b2252;">'N'</span>, coord2, (point_num*3));
|
|
|
|
<span style="color: #0000ff;">assert</span>(rc == QMCKL_SUCCESS);
|
|
|
|
|
|
|
|
<span style="color: #a020f0;">for</span> (<span style="color: #228b22;">int64_t</span> <span style="color: #a0522d;">i</span>=0 ; i<3*point_num ; ++i) {
|
|
|
|
assert( coord[i] == coord2[i] );
|
|
|
|
}
|
|
|
|
|
|
|
|
rc = qmckl_get_point (context, <span style="color: #8b2252;">'T'</span>, coord2, (point_num*3));
|
|
|
|
<span style="color: #0000ff;">assert</span>(rc == QMCKL_SUCCESS);
|
|
|
|
|
|
|
|
<span style="color: #a020f0;">for</span> (<span style="color: #228b22;">int64_t</span> <span style="color: #a0522d;">i</span>=0 ; i<point_num ; ++i) {
|
|
|
|
assert( coord[3*i+0] == coord2[i] );
|
|
|
|
assert( coord[3*i+1] == coord2[i+point_num] );
|
|
|
|
assert( coord[3*i+2] == coord2[i+point_num*2] );
|
|
|
|
}
|
|
|
|
|
|
|
|
rc = qmckl_set_point (context, <span style="color: #8b2252;">'T'</span>, point_num, coord2, (point_num*3));
|
|
|
|
<span style="color: #0000ff;">assert</span>(rc == QMCKL_SUCCESS);
|
|
|
|
|
|
|
|
rc = qmckl_get_point (context, <span style="color: #8b2252;">'N'</span>, coord3, (point_num*3));
|
|
|
|
<span style="color: #0000ff;">assert</span>(rc == QMCKL_SUCCESS);
|
|
|
|
|
|
|
|
<span style="color: #a020f0;">for</span> (<span style="color: #228b22;">int64_t</span> <span style="color: #a0522d;">i</span>=0 ; i<3*point_num ; ++i) {
|
|
|
|
assert( coord[i] == coord3[i] );
|
|
|
|
}
|
|
|
|
|
|
|
|
</pre>
|
|
|
|
</div>
|
|
|
|
</div>
|
|
|
|
</div>
|
|
|
|
</div>
|
|
|
|
</div>
|
|
|
|
<div id="postamble" class="status">
|
|
|
|
<p class="author">Author: TREX CoE</p>
|
2022-12-09 11:14:08 +01:00
|
|
|
<p class="date">Created: 2022-12-09 Fri 10:13</p>
|
2022-09-28 18:04:21 +02:00
|
|
|
<p class="validation"><a href="http://validator.w3.org/check?uri=referer">Validate</a></p>
|
|
|
|
</div>
|
|
|
|
</body>
|
|
|
|
</html>
|