<html><head></head><body><div style="color:#000; background-color:#fff; font-family:times new roman, new york, times, serif;font-size:16px"><div id="yui_3_16_0_ym19_1_1471523100749_6462"><span></span></div><div class="qtdSeparateBR"><br><br></div><div class="yahoo_quoted" id="yui_3_16_0_ym19_1_1471523100749_6466" style="display: block;"> <div style="font-family: times new roman, new york, times, serif; font-size: 16px;" id="yui_3_16_0_ym19_1_1471523100749_6465"> <div style="font-family: HelveticaNeue, Helvetica Neue, Helvetica, Arial, Lucida Grande, sans-serif; font-size: 16px;" id="yui_3_16_0_ym19_1_1471523100749_6464"> <div dir="ltr" id="yui_3_16_0_ym19_1_1471523100749_6463"> <font size="2" face="Arial" id="yui_3_16_0_ym19_1_1471523100749_6474"> <br><br></font></div><div class="y_msg_container" id="yui_3_16_0_ym19_1_1471523100749_6484"><div id="yiv5699041173"><div id="yui_3_16_0_ym19_1_1471523100749_6483"><div style="color:#000;background-color:#fff;font-family:times new roman, new york, times, serif;font-size:16px;" id="yui_3_16_0_ym19_1_1471523100749_6482"><div id="yiv5699041173yui_3_16_0_ym19_1_1471512966884_7678"><span></span></div><div class="yiv5699041173qtdSeparateBR" id="yiv5699041173yui_3_16_0_ym19_1_1471512966884_7679">Dear QE experts and users</div><div class="yiv5699041173qtdSeparateBR" id="yiv5699041173yui_3_16_0_ym19_1_1471512966884_7679"><br clear="none"></div><div class="yiv5699041173qtdSeparateBR" dir="ltr" id="yiv5699041173yui_3_16_0_ym19_1_1471512966884_7679">I'm a beginner QE user and few days ago I was asking for help but did not receive any response. I need to know whether I can calculate a molecule that set between two Au slab by QE? and if yes what should I do? how do i construct this structure?</div><div class="yiv5699041173qtdSeparateBR" dir="ltr" id="yiv5699041173yui_3_16_0_ym19_1_1471512966884_7679"><br clear="none"></div><div class="yiv5699041173qtdSeparateBR" dir="ltr" id="yiv5699041173yui_3_16_0_ym19_1_1471512966884_7679">I very appreciate if anyone can help me.</div><div class="yiv5699041173qtdSeparateBR" dir="ltr" id="yiv5699041173yui_3_16_0_ym19_1_1471512966884_7679"><br clear="none"></div><div class="yiv5699041173qtdSeparateBR" dir="ltr" id="yiv5699041173yui_3_16_0_ym19_1_1471512966884_7679">sincerely</div><div class="yiv5699041173yqt4896601627" id="yiv5699041173yqtfd21158"><div class="yiv5699041173yahoo_quoted" id="yiv5699041173yui_3_16_0_ym19_1_1471512966884_7684" style="display:block;"><div id="yiv5699041173yui_3_16_0_ym19_1_1471512966884_7683" style="font-family:times new roman, new york, times, serif;font-size:16px;"><div id="yiv5699041173yui_3_16_0_ym19_1_1471512966884_7682" style="font-family:HelveticaNeue, Helvetica Neue, Helvetica, Arial, Lucida Grande, sans-serif;font-size:16px;"><div class="yiv5699041173y_msg_container" id="yiv5699041173yui_3_16_0_ym19_1_1471512966884_7704"><div id="yiv5699041173"><div id="yiv5699041173yui_3_16_0_ym19_1_1471512966884_7714"><div id="yiv5699041173yui_3_16_0_ym19_1_1471512966884_7713" style="color:#000;background-color:#fff;font-family:times new roman, new york, times, serif;font-size:16px;"><div align="right" dir="ltr" id="yiv5699041173yui_3_16_0_ym19_1_1471040176554_23848" style="text-align:right;"><span dir="LTR"><br clear="none"></span></div><div align="right" dir="ltr" id="yiv5699041173yui_3_16_0_ym19_1_1471040176554_23848" style="text-align:left;"><br clear="none"></div></div></div></div><br clear="none"><br clear="none"></div> </div> </div> </div></div></div></div></div><br><br></div> </div> </div> </div></div></body></html>