<div dir="ltr"><div>Dear admin and all group member, <br></div><div>Can anybody help me by providing the basis set and potential (preferably for PBE xc potential) for geometry optimization AuSe system? <br></div><div>my input :     <br></div><div>    &KIND Se<br>      BASIS_SET DZVP-GTH-PADE<br>      POTENTIAL GTH-PADE-q6<br>    &END KIND<br>    &KIND Ag<br>      BASIS_SET DZVP-GTH-PADE<br>      POTENTIAL GTH-PADE-q11<br>    &END KIND</div><div><br></div><div>Error info:</div><div> *******************************************************************************<br> *   ___                                                                       *<br> *  /   \                                                                      *<br> * [ABORT]                                                                     *<br> *  \___/    The requested basis set <DZVP-GTH-PADE> for element <SE> was not  *<br> *    |                 found in the basis set files <./BASIS_SET>             *<br> *  O/|                                                                        *<br> * /| |                                                                        *<br> * / \                                          aobasis/basis_set_types.F:1536 *<br> *******************************************************************************<br><br>Please help me in this aspect.<br></div></div>