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<a href="GaussianQuadratureBase_8cc.html">Go to the documentation of this file.</a><div class="fragment"><div class="line"><a id="l00001" name="l00001"></a><span class="lineno"> 1</span><span class="comment">/*</span></div>
<div class="line"><a id="l00002" name="l00002"></a><span class="lineno"> 2</span><span class="comment"> * Copyright 2009-2020 The VOTCA Development Team</span></div>
<div class="line"><a id="l00003" name="l00003"></a><span class="lineno"> 3</span><span class="comment"> * (http://www.votca.org)</span></div>
<div class="line"><a id="l00004" name="l00004"></a><span class="lineno"> 4</span><span class="comment"> *</span></div>
<div class="line"><a id="l00005" name="l00005"></a><span class="lineno"> 5</span><span class="comment"> * Licensed under the Apache License, Version 2.0 (the "License")</span></div>
<div class="line"><a id="l00006" name="l00006"></a><span class="lineno"> 6</span><span class="comment"> *</span></div>
<div class="line"><a id="l00007" name="l00007"></a><span class="lineno"> 7</span><span class="comment"> * You may not use this file except in compliance with the License.</span></div>
<div class="line"><a id="l00008" name="l00008"></a><span class="lineno"> 8</span><span class="comment"> * You may obtain a copy of the License at</span></div>
<div class="line"><a id="l00009" name="l00009"></a><span class="lineno"> 9</span><span class="comment"> *</span></div>
<div class="line"><a id="l00010" name="l00010"></a><span class="lineno"> 10</span><span class="comment"> * http://www.apache.org/licenses/LICENSE-2.0</span></div>
<div class="line"><a id="l00011" name="l00011"></a><span class="lineno"> 11</span><span class="comment"> *</span></div>
<div class="line"><a id="l00012" name="l00012"></a><span class="lineno"> 12</span><span class="comment"> * Unless required by applicable law or agreed to in writing, software</span></div>
<div class="line"><a id="l00013" name="l00013"></a><span class="lineno"> 13</span><span class="comment"> * distributed under the License is distributed on an "AS IS" BASIS,</span></div>
<div class="line"><a id="l00014" name="l00014"></a><span class="lineno"> 14</span><span class="comment"> * WITHOUT WARRANTIES OR CONDITIONS OF ANY KIND, either express or implied.</span></div>
<div class="line"><a id="l00015" name="l00015"></a><span class="lineno"> 15</span><span class="comment"> * See the License for the specific language governing permissions and</span></div>
<div class="line"><a id="l00016" name="l00016"></a><span class="lineno"> 16</span><span class="comment"> * limitations under the License.</span></div>
<div class="line"><a id="l00017" name="l00017"></a><span class="lineno"> 17</span><span class="comment"> *</span></div>
<div class="line"><a id="l00018" name="l00018"></a><span class="lineno"> 18</span><span class="comment"> */</span></div>
<div class="line"><a id="l00019" name="l00019"></a><span class="lineno"> 19</span> </div>
<div class="line"><a id="l00020" name="l00020"></a><span class="lineno"> 20</span><span class="comment">// Local VOTCA includes</span></div>
<div class="line"><a id="l00021" name="l00021"></a><span class="lineno"> 21</span><span class="preprocessor">#include "<a class="code" href="GaussianQuadratureBase_8h.html">votca/xtp/GaussianQuadratureBase.h</a>"</span></div>
<div class="line"><a id="l00022" name="l00022"></a><span class="lineno"> 22</span> </div>
<div class="line"><a id="l00023" name="l00023"></a><span class="lineno"> 23</span><span class="keyword">namespace </span><a class="code hl_namespace" href="namespacevotca.html">votca</a> {</div>
<div class="line"><a id="l00024" name="l00024"></a><span class="lineno"> 24</span><span class="keyword">namespace </span>xtp {</div>
<div class="foldopen" id="foldopen00025" data-start="{" data-end="}">
<div class="line"><a id="l00025" name="l00025"></a><span class="lineno"><a class="line" href="classvotca_1_1xtp_1_1GaussianQuadratureBase.html#abbd49433ba9594d954a0af5b8e0bb8f5"> 25</a></span><span class="keywordtype">void</span> <a class="code hl_function" href="classvotca_1_1xtp_1_1GaussianQuadratureBase.html#abbd49433ba9594d954a0af5b8e0bb8f5">GaussianQuadratureBase::CheckOrder</a>(</div>
<div class="line"><a id="l00026" name="l00026"></a><span class="lineno"> 26</span> <a class="code hl_typedef" href="namespacevotca.html#a947412fbe82041cb9f5ec8dfd56d67b1">Index</a> order, <span class="keyword">const</span> std::map<Index, Eigen::VectorXd>& map)<span class="keyword"> const </span>{</div>
<div class="line"><a id="l00027" name="l00027"></a><span class="lineno"> 27</span> <span class="keywordflow">if</span> (map.count(order) == 0) {</div>
<div class="line"><a id="l00028" name="l00028"></a><span class="lineno"> 28</span> std::string keys = <span class="stringliteral">"{ "</span>;</div>
<div class="line"><a id="l00029" name="l00029"></a><span class="lineno"> 29</span> <span class="keywordflow">for</span> (<span class="keyword">const</span> <span class="keyword">auto</span>& pair : map) {</div>
<div class="line"><a id="l00030" name="l00030"></a><span class="lineno"> 30</span> keys += std::to_string(pair.first) + <span class="stringliteral">" "</span>;</div>
<div class="line"><a id="l00031" name="l00031"></a><span class="lineno"> 31</span> }</div>
<div class="line"><a id="l00032" name="l00032"></a><span class="lineno"> 32</span> keys += <span class="stringliteral">"}"</span>;</div>
<div class="line"><a id="l00033" name="l00033"></a><span class="lineno"> 33</span> <span class="keywordflow">throw</span> std::invalid_argument(<span class="stringliteral">"Order "</span> + std::to_string(order) + <span class="stringliteral">" not in "</span> +</div>
<div class="line"><a id="l00034" name="l00034"></a><span class="lineno"> 34</span> keys +</div>
<div class="line"><a id="l00035" name="l00035"></a><span class="lineno"> 35</span> <span class="stringliteral">". Please "</span></div>
<div class="line"><a id="l00036" name="l00036"></a><span class="lineno"> 36</span> <span class="stringliteral">" select one of these numbers"</span>);</div>
<div class="line"><a id="l00037" name="l00037"></a><span class="lineno"> 37</span> }</div>
<div class="line"><a id="l00038" name="l00038"></a><span class="lineno"> 38</span>}</div>
</div>
<div class="line"><a id="l00039" name="l00039"></a><span class="lineno"> 39</span> </div>
<div class="line"><a id="l00040" name="l00040"></a><span class="lineno"> 40</span>} <span class="comment">// namespace xtp</span></div>
<div class="line"><a id="l00041" name="l00041"></a><span class="lineno"> 41</span>} <span class="comment">// namespace votca</span></div>
<div class="ttc" id="aGaussianQuadratureBase_8h_html"><div class="ttname"><a href="GaussianQuadratureBase_8h.html">GaussianQuadratureBase.h</a></div></div>
<div class="ttc" id="aclassvotca_1_1xtp_1_1GaussianQuadratureBase_html_abbd49433ba9594d954a0af5b8e0bb8f5"><div class="ttname"><a href="classvotca_1_1xtp_1_1GaussianQuadratureBase.html#abbd49433ba9594d954a0af5b8e0bb8f5">votca::xtp::GaussianQuadratureBase::CheckOrder</a></div><div class="ttdeci">void CheckOrder(Index order, const std::map< Index, Eigen::VectorXd > &map) const</div><div class="ttdef"><b>Definition</b> <a href="#l00025">GaussianQuadratureBase.cc:25</a></div></div>
<div class="ttc" id="anamespacevotca_html"><div class="ttname"><a href="namespacevotca.html">votca</a></div><div class="ttdoc">base class for all analysis tools</div><div class="ttdef"><b>Definition</b> <a href="basebead_8h_source.html#l00033">basebead.h:33</a></div></div>
<div class="ttc" id="anamespacevotca_html_a947412fbe82041cb9f5ec8dfd56d67b1"><div class="ttname"><a href="namespacevotca.html#a947412fbe82041cb9f5ec8dfd56d67b1">votca::Index</a></div><div class="ttdeci">Eigen::Index Index</div><div class="ttdef"><b>Definition</b> <a href="types_8h_source.html#l00026">types.h:26</a></div></div>
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