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		<title><![CDATA[Multiwfn forum / Electron Density with various q]]></title>
		<link>http://sobereva.com/wfnbbs/viewtopic.php?id=1822</link>
		<description><![CDATA[The most recent posts in Electron Density with various q.]]></description>
		<lastBuildDate>Wed, 29 Apr 2026 01:33:04 +0000</lastBuildDate>
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			<title><![CDATA[Re: Electron Density with various q]]></title>
			<link>http://sobereva.com/wfnbbs/viewtopic.php?pid=5665#p5665</link>
			<description><![CDATA[<p>Hello,</p><p>There is no so-called &quot;extra point charge&quot; in this context. Electron density is calculated directly based on wavefunction according to the equation given in Section 2.6 of Multiwfn manual.</p>]]></description>
			<author><![CDATA[dummy@example.com (sobereva)]]></author>
			<pubDate>Wed, 29 Apr 2026 01:33:04 +0000</pubDate>
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			<title><![CDATA[Electron Density with various q]]></title>
			<link>http://sobereva.com/wfnbbs/viewtopic.php?pid=5664#p5664</link>
			<description><![CDATA[<p>Hello,</p><p>I would like to plot the electron density along a line. To achieve this, I would simply do the following after loading my file into multiwfn:<br />3<br />1<br />2<br />-5,0,0,5,0,0 A<br />However, I guess the default for the extra point charge used to compute the ESP is q = -1.00. Is there a way to tune this value, so that one could compute the electron density along a line with different values of q?</p><p>Thank you</p>]]></description>
			<author><![CDATA[dummy@example.com (Ainosya)]]></author>
			<pubDate>Tue, 28 Apr 2026 18:51:29 +0000</pubDate>
			<guid>http://sobereva.com/wfnbbs/viewtopic.php?pid=5664#p5664</guid>
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