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Chemcraft - Blog

<HTML> <HEAD> <meta http-equiv="Content-Language" content="en-us"> <TITLE>Chemcraft - Blog</TITLE> <meta name="Description" CONTENT="A convenient graphical program for working with quantum chemistry calculations. Provides visualization of Gamess/Gaussian output files, useful utilities for preparing new jobs for calculation."> </HEAD> <BODY BGCOLOR=#F3F3F3> <div align="center"> <TABLE WIDTH=710 BORDER=1 CELLPADDING=0 CELLSPACING=0 bordercolor="#FFFFFF" bgcolor="#FFFFFF"> <TR> <TD rowspan=3 height="200" width="129" bordercolor="#808080"> <p><font size="4"><IMG SRC="images/molecule.jpg" width=123 height=200 align="top">&nbsp;</font></p></TD> <TD COLSPAN=7 height="130" width="534" bordercolor="#808080"> <p align="center"> <font size="4"> <IMG SRC="images/title.jpg" width=427 height=129 align="center"></font></p></TD> </TR> <TR> <td width="87" height="35" align=center bordercolor="#808080"><a href="index.html" class="menu"><font size="4">Main</font></a></td> <td width="85" height="35" align=center bordercolor="#808080"><a href="news.html" class="menu"><font size="4">News</font></a></td> <td width="126" height="35" align=center bordercolor="#808080"><a href="description.html" class="menu"><font size="4">Description</font></a></td> <td width="118" height="35" align=center bordercolor="#808080"><a href="download.html" class="menu"><font size="4">Download</font></a></td> <td width="98" height="35" align=center bordercolor="#808080"><a href="contacts.html" class="menu"><font size="4">Contacts</font></a></td> <td width="86" height="35" align=center bordercolor="#808080"><a href="help.html" class="menu"><font size="4">Help</font></a></td> <td width="80" height="35" align=center bordercolor="#808080"><b><font size="4">Blog</font></b></td> </TR> <TR> <td width="87" height="35" align=center bordercolor="#808080"><a href="order.html" class="menu"><font size="4">Order</font></a></td> <td width="85" height="35" align=center bordercolor="#808080"><a href="/cgi-bin/update.pl" class="menu"><font size="4">Update</font></a></td> <td width="126" height="35" align=center bordercolor="#808080"><a href="gallery.html" class="menu"><font size="4">Gallery</font></a></td> <td width="118" height="35" align=center bordercolor="#808080"><a href="about.html" class="menu"><font size="4">About Us</font></a></td> <td width="98" height="35" align=center bordercolor="#808080"><a href="links.html" class="menu"><font size="4">Links</font></a></td> <td width="86" height="35" align=center bordercolor="#808080"><a href="forum.html" class="menu"><font size="4">Forum</font></a></td> <td width="80" height="35" align=center bordercolor="#808080"><a href="citation.html" class="menu"><font size="4">Citation</font></a></td> </TR> <TR> <TD colspan="8" height="405" valign="top" width="671"> <p style="word-spacing: 0; line-height: 150%; margin-top: 0; margin-bottom: 0"><font size="4"><br> </font> <blockquote> <center> <p class="MsoNormal" style="line-height: 150%; word-spacing: 0; margin-top: 0; margin-bottom: 0" align="center"><b><font size="4">Computational chemistry blog:</font></b></p> <p align="center" style="text-indent: 8; line-height: 150%; word-spacing: 0; margin-left: 4; margin-right: 4; margin-top: 0; margin-bottom: 0"><font size="4">&nbsp;</font></p> <blockquote> <p align="right" style="line-height: 150%; word-spacing: 0; margin-top: 0; margin-bottom: 0">&nbsp;</p> <p align="right" style="line-height: 150%; word-spacing: 0; margin-top: 0; margin-bottom: 0"><a href="http://simplecompchem.blogspot.com/"><font size="4">http://simplecompchem.blogspot.com/</font></a></p> <p align="right" style="line-height: 150%; word-spacing: 0; margin-top: 0; margin-bottom: 0"><font size="4">&nbsp;</font></p> <p align="right" style="line-height: 150%; word-spacing: 0; margin-top: 0; margin-bottom: 0">&nbsp;</p> <p align="right" style="line-height: 150%; word-spacing: 0; margin-top: 0; margin-bottom: 0"> <font size="4">Chemcraft-related topics:</font></p> <p align="right" style="line-height: 150%; word-spacing: 0; margin-top: 0; margin-bottom: 0"><font size="4">&nbsp;</font></p> <p align="right" style="line-height: 150%; word-spacing: 0; margin-top: 0; margin-bottom: 0"><font size="4"> <a href="http://simplecompchem.blogspot.com/2016/02/why-we-havent-yet-implemented-gui-for.html">Why we haven抰 yet implemented a GUI for creating input files in Chemcraft</a></font></p> <p align="right" style="line-height: 150%; word-spacing: 0; margin-top: 0; margin-bottom: 0"><font size="4">&nbsp;</font></p> <p align="right" style="line-height: 150%; word-spacing: 0; margin-top: 0; margin-bottom: 0"> <font size="4"> <a href="http://simplecompchem.blogspot.com/2018/09/the-importance-of-gallery-page-of.html"> The importance of the Gallery page of Chemcraft website</a></font></p> <p align="right" style="line-height: 150%; word-spacing: 0; margin-top: 0; margin-bottom: 0"><font size="4">&nbsp;</font></p> <p align="right" style="line-height: 150%; word-spacing: 0; margin-top: 0; margin-bottom: 0">&nbsp;</p> <p align="right" style="line-height: 150%; word-spacing: 0; margin-top: 0; margin-bottom: 0">&nbsp;</p> <p align="right" style="line-height: 150%; word-spacing: 0; margin-top: 0; margin-bottom: 0"> <font size="4">Computational chemistry:</font></p> <p align="right" style="line-height: 150%; word-spacing: 0; margin-top: 0; margin-bottom: 0"><font size="4">&nbsp;</font></p> <p align="right" style="line-height: 150%; word-spacing: 0; margin-top: 0; margin-bottom: 0"><font size="4"> <a href="http://simplecompchem.blogspot.com/2015/12/correlations-between-computed-and.html">Correlations between computed and experimental properties</a></font></p> <p align="right" style="line-height: 150%; word-spacing: 0; margin-top: 0; margin-bottom: 0"><font size="4">&nbsp;</font></p> <p align="right" style="line-height: 150%; word-spacing: 0; margin-top: 0; margin-bottom: 0"><font size="4"> <a href="http://simplecompchem.blogspot.com/2016/04/some-useful-links-for-people-dealing.html">Some useful links for people dealing with quantum chemistry</a>&nbsp;</font></p> <p align="right" style="line-height: 150%; word-spacing: 0; margin-top: 0; margin-bottom: 0">&nbsp;</p> <p align="right" style="line-height: 150%; word-spacing: 0; margin-top: 0; margin-bottom: 0"><font size="4"> <a href="http://simplecompchem.blogspot.com/2016/06/dft-advices.html">Dft advices</a></font></p> <p align="right" style="line-height: 150%; word-spacing: 0; margin-top: 0; margin-bottom: 0"><font size="4">&nbsp;</font></p> <p align="right" style="line-height: 150%; word-spacing: 0; margin-top: 0; margin-bottom: 0"><font size="4"> <a href="http://simplecompchem.blogspot.com/2017/06/the-basics-of-high-accuracy-ab-initio.html">The basics of high-accuracy ab initio computations (Feller-Peterson-Dixon method)</a></font></p> <p align="right" style="line-height: 150%; word-spacing: 0; margin-top: 0; margin-bottom: 0"><font size="4">&nbsp;</font></p> <p align="right" style="line-height: 150%; word-spacing: 0; margin-top: 0; margin-bottom: 0">&nbsp;</p> </blockquote> </center> </blockquote> <p align="right" style="line-height: 150%; word-spacing: 0; margin-top: 0; margin-bottom: 0">&nbsp;</p> <p align="left" style="word-spacing: 0; line-height: 150%; margin-top: 0; margin-bottom: 0"><font size="4">&nbsp; </font> <p align="right" style="word-spacing: 0; line-height: 150%; margin-top: 0; margin-bottom: 0"><font size="4">Our research work:</font><p align="right" style="word-spacing: 0; line-height: 150%; margin-top: 0; margin-bottom: 0"> <font size="4"> <a href="http://simplecompchem.blogspot.com/2018/06/structural-properties-of-nematic-schiff.html"> Structural properties of nematic Schiff bases and prediction of their thermal stability by polarizability anisotropy computed via DFT </a></font> <p align="right" style="word-spacing: 0; line-height: 150%; margin-top: 0; margin-bottom: 0"> &nbsp;<p align="right" style="word-spacing: 0; line-height: 150%; margin-top: 0; margin-bottom: 0"> <span lang="EN-US" style="mso-ansi-language:EN-US"><font size="4"><a href="https://simplecompchem.blogspot.com/2022/11/using-quantum-chemistry-to-interpret-ir.html">Using Quantum Chemistry for Interpreting the IR Spectra of Chemisorbed Gases</a></font> </span> <p align="right" style="word-spacing: 0; line-height: 150%; margin-top: 0; margin-bottom: 0"> &nbsp;<p align="right" style="word-spacing: 0; line-height: 150%; margin-top: 0; margin-bottom: 0"> <a href="https://simplecompchem.blogspot.com/2024/09/qspr-prediction-of-acidities-of.html"><font size="4">QSPR prediction of the acidities of carboxylic acids and phenols with different approaches</font></a><p align="right" style="word-spacing: 0; line-height: 150%; margin-top: 0; margin-bottom: 0"> <span lang="EN-US" style="mso-ansi-language:EN-US"><font size="4"><o:p> </font> </span> <p align="right" style="word-spacing: 0; line-height: 150%; margin-top: 0; margin-bottom: 0"> &nbsp;<p align="right" style="word-spacing: 0; line-height: 150%; margin-top: 0; margin-bottom: 0"> <span lang="EN-US" style="mso-ansi-language:EN-US">&nbsp; </span> <p align="right" style="word-spacing: 0; line-height: 150%; margin-top: 0; margin-bottom: 0"> &nbsp;<p align="right" style="word-spacing: 0; line-height: 150%; margin-top: 0; margin-bottom: 0"> <span lang="EN-US" style="mso-ansi-language:EN-US"> </o:p> </span> <p align="left" style="word-spacing: 0; line-height: 150%; margin-top: 0; margin-bottom: 0"><font size="4">&nbsp;</font> <p align="left" style="word-spacing: 0; line-height: 150%; margin-top: 0; margin-bottom: 0">&nbsp;<p align="left" style="word-spacing: 0; line-height: 150%; margin-top: 0; margin-bottom: 0">&nbsp;<p align="left" style="word-spacing: 0; line-height: 150%; margin-top: 0; margin-bottom: 0"><font size="4">&nbsp; Here you can read another blog of the author of Chemcraft program, not related to chemistry:</font><p align="right" style="word-spacing: 0; line-height: 150%; margin-top: 0; margin-bottom: 0"> <font size="4"> <a href="http://grandrienko.blogspot.com/">http://grandrienko.blogspot.com/</a></font><p align="left" style="word-spacing: 0; line-height: 150%; margin-top: 0; margin-bottom: 0"><font size="4">&nbsp; This blog is devoted to political science, philosophy, etc. Sorry for politics on Chemcraft website, but this blog is rather important for us:</font><p align="right" style="word-spacing: 0; line-height: 150%; margin-top: 0; margin-bottom: 0"> <font size="4"> <a href="https://grandrienko.blogspot.com/2021/04/why-people-do-not-change-their-views.html"> Why people do not change their views</a></font><p align="right" style="word-spacing: 0; line-height: 150%; margin-top: 0; margin-bottom: 0"><font size="4"><a href="https://grandrienko.blogspot.com/2021/05/about-democracy.html">Why democracy matters: lessons from history</a></font><p align="right" style="word-spacing: 0; line-height: 150%; margin-top: 0; margin-bottom: 0"><font size="4"><a href="https://grandrienko.blogspot.com/2021/09/social-lifts-in-big-politics.html">How to improve the democracy</a></font><p align="right" style="word-spacing: 0; line-height: 150%; margin-top: 0; margin-bottom: 0"><font size="4"> <a href="https://grandrienko.blogspot.com/2021/10/friendship-vs-sectarianism.html"> Friendship vs sectarianism</a></font><p align="right" style="word-spacing: 0; line-height: 150%; margin-top: 0; margin-bottom: 0"><font size="4"> <a href="https://grandrienko.blogspot.com/2022/01/consumer-society-and-youtube.html"> Consumer society and youtube</a></font><p align="right" style="word-spacing: 0; line-height: 150%; margin-top: 0; margin-bottom: 0"><font size="4"> <a href="https://grandrienko.blogspot.com/2021/10/the-market-economy-and-reputation.html"> The market economy and reputation</a></font><p align="right" style="word-spacing: 0; line-height: 150%; margin-top: 0; margin-bottom: 0"><font size="4"><a href="https://grandrienko.blogspot.com/2022/12/referendum-democracy-how-it-can-work.html">&quot;Referendum democracy&quot; - how it can work</a></font><p align="right" style="word-spacing: 0; line-height: 150%; margin-top: 0; margin-bottom: 0">&nbsp;<p align="right" style="word-spacing: 0; line-height: 150%; margin-top: 0; margin-bottom: 0">&nbsp;<p align="right" style="word-spacing: 0; line-height: 150%; margin-top: 0; margin-bottom: 0"><font size="4">AI </font><font size="4">music video:</font><p align="right" style="word-spacing: 0; line-height: 150%; margin-top: 0; margin-bottom: 0">&nbsp;<p align="right" style="word-spacing: 0; line-height: 150%; margin-top: 0; margin-bottom: 0"><font size="4">&quot;The World of Post-Truth&quot;:</font><p align="right" style="word-spacing: 0; line-height: 150%; margin-top: 0; margin-bottom: 0"><font size="4"><a href="https://www.youtube.com/watch?v=mrlInUJSA4U">https://www.youtube.com/watch?v=mrlInUJSA4U</a></font><p align="right" style="word-spacing: 0; line-height: 150%; margin-top: 0; margin-bottom: 0">&nbsp;<p align="right" style="word-spacing: 0; line-height: 150%; margin-top: 0; margin-bottom: 0">&nbsp;<p align="left" style="word-spacing: 0; line-height: 150%; margin-top: 0; margin-bottom: 0"><font size="4">&nbsp;</font><p align="left" style="word-spacing: 0; line-height: 150%; margin-top: 0; margin-bottom: 0">&nbsp;<p align="left" style="word-spacing: 0; line-height: 150%; margin-top: 0; margin-bottom: 0"> <font size="4">&nbsp; Previously this blog contained some articles about Russia and Ukraine, but we had to remove them, because we live in Russia and it is quite dangerous for us to express out political views in the Web. Unfortunately, currently it is too difficult for us to emigrate from Russia.<br> <br> <br> &nbsp;</font><p align="left">&nbsp;<p align="left">&nbsp; </TD> </TR> </TABLE> </div> </BODY> </HTML>

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