mirror of
https://github.com/LCPQ/QUESTDB_website.git
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203 lines
7.0 KiB
HTML
203 lines
7.0 KiB
HTML
---
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title: "One dataset"
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date: 2019-08-29 09:00
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draft: false
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---
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<link rel="stylesheet" type="text/css" href="/css/modal.css" />
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<script src="/js/processingIndicator.js" type="text/javascript"></script>
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<script src="/js/data.js" type="text/javascript"></script>
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<script src="/js/loadAllData.js" type="text/javascript"></script>
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<script src="/js/getFullDataPath.js" type="text/javascript"></script>
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<script src="/js/getTextFromFile.js" type="text/javascript"></script>
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<script src="/js/trueTypeOf.js" type="text/javascript"></script>
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<script src="/js/noNan.js"></script>
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<script src="/js/websiteFile.js"></script>
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{{< getDataFilesName >}}
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<script>
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window.onload=async function()
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{
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window.Cite = require('citation-js');
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window.dats=await loadAllData()
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window.data=new CombinedData()
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molecules=new Set(Object.values(window.dats).flat().map((d)=>d.molecule))
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for (const el of molecules) {
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op=document.createElement("option")
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op.value=el
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op.innerText=el
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document.getElementById("select_mol").appendChild(op)
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}
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}
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function select_mol_onchange(event){
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update_mol(event.target.value)
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}
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function select_abs_onchange(event){
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update_abs(window.dats["abs"][event.target.value])
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}
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function select_fluo_onchange(event){
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update_fluo(window.dats["fluo"][event.target.value])
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}
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function select_ZPE_onchange(event){
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update_ZPE(window.dats["ZPE"][event.target.value])
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}
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async function update_mol(molecule){
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processingIndicator.isActive=true
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for (const [key,dat] of Object.entries(window.dats)) {
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var s=document.getElementById(String.raw`select_${key}`)
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$(s).find('option[value!=""]').remove()
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$(s).find('option[value=""]').first().prop('selected', true)
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dat.forEach((val,index)=>{
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if(val.molecule==molecule){
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var op=document.createElement("option")
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op.value=index
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op.innerText=val.method.toString()
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s.appendChild(op)
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}
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})
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}
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processingIndicator.isActive=false
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}
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async function update_abs(abs){
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window.data.Abs=abs
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reload()
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}
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async function update_fluo(fluo){
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window.data.Fluo=fluo
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reload()
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}
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async function update_ZPE(ZPE){
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window.data.ZPE=ZPE
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reload()
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}
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async function clear(){
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for(id of ["ex_table_b","data_par"]){
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document.getElementById(id).innerHTML=""
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}
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}
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async function reload() {
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processingIndicator.isActive=true
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clear()
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const LatexInline=['\\(','\\)']
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var par=document.getElementById("data_par")
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var md=[];
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var els=[];
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var customRenderingProp=["excitations","sourceFile"]
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for (const key of Object.keys(window.data)) {
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if (window.data[key]!=null){
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md.push(key)
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for (const prop of Object.keys(window.data[key])) {
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if(!(customRenderingProp.includes(prop)))
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md.push([prop,window.data[key][prop]])
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}
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md.push(window.data[key].DOI)
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md.push(window.data[key].sourceFile)
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}
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}
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div=document.getElementById("meta_div")
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div.innerHTML=""
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for (const element of md) {
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var node =null;
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switch (trueTypeOf(element)) {
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case "string":
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node= document.createElement("h2");
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node.innerText=element;
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break;
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case "doi":
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var publi=await Cite.async(element.string)
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var output = publi.format('bibliography', {
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format: 'html',
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template: 'apa',
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lang: 'en-US'
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})
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node=document.createElement("a")
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node.innerHTML=output
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node.target='_blank'
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node.href=element.url
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break
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case "websiteFile":
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node=document.createElement("a")
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node.innerText="Go to file"
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node.target='_blank'
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node.href= await element.getViewerURL()
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break
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case "Array":
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k=element[0]
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v=element[1]
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k=k.charAt(0).toUpperCase() + k.slice(1)
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node = document.createElement("div");
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node.innerText= k+': '+v;
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break;
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}
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div.appendChild(node);
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}
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var tb=document.getElementById("ex_table_b");
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for (const el of window.data.excitations) {
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var row=document.createElement("tr")
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var rowd=[]
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rowd.push(String.raw`${LatexInline[0]} ${el.initial.toLaTeX()} \rightarrow ${el.final.toLaTeX()}${LatexInline[1]}`)
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var e=[el.Eabs,el.Efluo,el.EZPE,el.Eadia,el.Ezz]
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e.forEach((val)=>rowd.push(noNanPrecision(val,3)))
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for(d of rowd) {
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td=document.createElement("td")
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td.innerText=d
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row.appendChild(td)
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}
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tb.appendChild(row)
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}
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await MathJax.typesetPromise();
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document.getElementById("ex_div").hidden=false
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await MathJax.typesetPromise();
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processingIndicator.isActive=false
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}
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</script>
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<p>
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In this page you can calculate \(E_\text{adia}\) \(E_\text{0-0}\) from \(E_\text{abs}\) \(E_\text{fluo}\) and \(\Delta E_\text{ZPE}\)
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For this select a method for absorption, fluorescence or ZPE
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</p>
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<div>
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<label>Select a molecule<br/>
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<select id="select_mol" onchange="select_mol_onchange(event)">
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<option value="" disabled=true selected=true>Select a molecule</option>
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</select>
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</label>
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</div>
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<div>
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<label>Select an absorption method<br/>
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<select id="select_abs" onchange="select_abs_onchange(event)">
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<option value="" disabled=true selected=true>Select an absorption method</option>
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</select>
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</label>
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<label>Select a fluorescence method<br/>
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<select id="select_fluo" onchange="select_fluo_onchange(event)">
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<option value="" disabled=true selected=true>Select a fluorescence method</option>
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</select>
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</label>
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<label>Select a ZPE method<br/>
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<select id="select_ZPE" onchange="select_ZPE_onchange(event)">
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<option value="" disabled=true selected=true>Select a ZPE method</option>
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</select>
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</label>
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</div>
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<h1>Data</h1>
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<p id=data_par>
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<div id="meta_div"></div>
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<div id="ex_div" hidden=true>
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<h2>Excitation</h2>
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<table id="ex_table">
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<thead>
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<th>Transition</th>
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<th>\(E_\text{abs}\)</th>
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<th>\(E_\text{fluo}\)</th>
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<th>\(\Delta E_\text{ZPE}\)</th>
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<th>\(E_\text{adia}\)</th>
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<th>\(E_\text{0-0}\)</th>
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</thead>
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<tbody id="ex_table_b">
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</tbody>
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</table>
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</div>
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</p>
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{{< waitModal >}} |