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		<title><![CDATA[Multiwfn forum / generation of .wfn files for fukui function calculation]]></title>
		<link>http://sobereva.com/wfnbbs/viewtopic.php?id=728</link>
		<description><![CDATA[The most recent posts in generation of .wfn files for fukui function calculation.]]></description>
		<lastBuildDate>Thu, 13 Oct 2022 10:43:22 +0000</lastBuildDate>
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			<title><![CDATA[Re: generation of .wfn files for fukui function calculation]]></title>
			<link>http://sobereva.com/wfnbbs/viewtopic.php?pid=2789#p2789</link>
			<description><![CDATA[<p>Dear Alessio,</p><p>The best way is, after generating N.gjf, N+1.gjf and N-1.gjf, run them on a server with high-end CPU, then download the three resulting .wfn files to your local machine and perform analysis using Multiwfn.</p><p>Best,</p><p>Tian</p>]]></description>
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			<pubDate>Thu, 13 Oct 2022 10:43:22 +0000</pubDate>
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			<title><![CDATA[generation of .wfn files for fukui function calculation]]></title>
			<link>http://sobereva.com/wfnbbs/viewtopic.php?pid=2788#p2788</link>
			<description><![CDATA[<p>Dear Multiwfn Users</p><p>Regarding to calculation of fukui function following phenol examples in 4.22 section:</p><p>is there any way to speed up production of N.wfn, N-1.wfn and N+1.wfn from formatted checkpoint file (.fhck)? </p><p>Do you know which features can accellerate this process?&#160; maybe use faster pc or with more cores, memory?</p><p>I appreciate a lot!</p><p>best regards </p><p>Alessio</p>]]></description>
			<author><![CDATA[dummy@example.com (AlessioM)]]></author>
			<pubDate>Thu, 13 Oct 2022 08:32:24 +0000</pubDate>
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