<div>Hi,</div>
<div> I think it si not too hard to convert EMSL basis set to the format used by CP2K.<br><br></div>
<div class="gmail_quote">2009/6/29 <a href="mailto:bari...@gmail.com">bari...@gmail.com</a> <span dir="ltr"><<a href="mailto:bari...@gmail.com">bari...@gmail.com</a>></span><br>
<blockquote class="gmail_quote" style="PADDING-LEFT: 1ex; MARGIN: 0px 0px 0px 0.8ex; BORDER-LEFT: #ccc 1px solid"><br>Dear all,<br><br>Is there a tool to automatically convert basis sets generated on the<br>EMSL website (<a href="https://bse.pnl.gov/bse/portal" target="_blank">https://bse.pnl.gov/bse/portal</a>) to a form that is<br>
usable by cp2k ( like the EMSL_BASIS_SETS in the tests directory) ?<br><br>Thanks<br><br>Baribefe<br></div><br><br clear="all">
<div></div><br>-- <br>À¾ý<br>