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HTML
89 lines
3.2 KiB
HTML
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<!DOCTYPE HTML PUBLIC "-//W3C//DTD HTML 4.01 Transitional//EN"
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"http://www.w3.org/TR/html4/loose.dtd">
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<html>
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<head>
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<title>NWChem Known Bugs</title>
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<link rel="stylesheet" type="text/css" href="../shared/nwchem_basic.css">
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</head>
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<body bgcolor="#FFFFFF">
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<table width="650">
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<tr>
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<td>
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<br>
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<table>
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<tbody>
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<tr>
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<td align="left" width="325"><img src="../images/nwchem_logo_dark.gif" border=0 width=200 alt="NWChem - computational chemistry on parallel computers"></td>
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<td align="right" width="325" valign="bottom">
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<a href="../nwchem_main.html">NWChem Home</a> |
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<a href="../disclaimer.html">Security & Privacy</a> |
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<a href="http://www.pnl.gov" target="_blank">PNNL</a>
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</td>
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</tr>
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</tbody>
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</table>
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<hr>
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<h1>NWChem Known Bugs</h1>
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<p>
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It is recommended that users use the defaults in NWChem.
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They have been set to provide maximum efficiency for most users.
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If you feel you must change one of the defaults, be aware that
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you are responsible for ensuring that the results are correct.
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<p>
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It is also recommended that users obtain the latest version of
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NWChem as many of the problems in previously released versions have
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been fixed in the latest release.
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<p>
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Below is a list of the known bugs in NWChem. If you believe
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that you have found bugs that are not listed here, please
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send your bug report using the correct channel listed in the
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<a href="support.html">Reporting Problems with NWChem page</a>.
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<ol>
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<li> <a href="known_bugs.4.7.html">Version 4.7 </a></li>
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<li> <a href="known_bugs.4.6.html">Version 4.6 </a></li>
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<li> <a href="known_bugs.4.5.html">Version 4.5 </a></li>
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<li> <a href="known_bugs.4.5.beta.html">Version 4.5 beta</a></li>
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<li> <a href="known_bugs.4.1.html">Version 4.1</a></li>
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<li> <a href="known_bugs.4.0.html">Version 4.0 and 4.0.1</a></li>
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<li> <a href="known_bugs.3.3.html">Version 3.3 and 3.3.1</a></li>
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<li> <a href="known_bugs.3.2.html">Version 3.2</a></li>
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</ol>
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<p>
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If you believe that you have bugs related to GA, please look at the
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<a href="http://www.emsl.pnl.gov/docs/global/support.html" target="_blank">
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Global Arrays Support Page</a> for more information.
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<p>
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<hr>
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<font size="0">
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<center>
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<a href="../nwchem_main.html">NWChem</a> |
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<a href="../capabilities/nwchem_capab.html">Capabilities</a> |
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<a href="../platforms/platforms.html">Platforms</a> |
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<a href="../download.html">Download</a> |
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<a href="../doc/user/index.html">User's Manual</a> |
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<a href="../doc/prog/index.html">Programmer's Manual</a> |
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<a href="../release-notes/index.html">Release Notes</a> |
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<a href="faq/NWChem_FAQ.html">FAQ</a>
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</center>
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<br>
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<center>
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<a href="known_bugs.html">Known Bugs</a> |
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<a href="support.html">Support</a> |
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<a href="../training/training.html">Tutorial</a> |
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<a href="../contributors.html">Contributors</a> |
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<a href="../benchmarks/index.html">Benchmarks</a> |
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<a href="http://www.emsl.pnl.gov/forms/search_nwchem.html">Search</a> |
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<a href="http://www.emsl.pnl.gov/docs/mssg/index.html" target="_blank">Mol Sci. Soft. Group</a> |
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<a href="../citation.html">Citation</a>
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</center>
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</font>
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<hr>
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Contact: <a href="mailto:ms3distribution@emsl.pnl.gov">NWChem Support</a><br>
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Updated: February 22, 2005
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</td></tr></table>
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</body>
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</html>
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</body>
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</html>
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