<div dir="ltr"><div>I have tried in different way but the error is same. As a very beginner, sometimes it becomes too difficult to understand it properly.</div><div>My input and output files are attached below.</div><div>The origin basis file location and details are here,</div><div>"/usr/share/cp2k"</div><div>ALL_BASIS_SETS     BASIS_def2_QZVP_RI_ALL  BASIS_pob-TZVP  DFTB             GTH_BASIS_SETS  MM_POTENTIAL         README                  vdW_kernel_table.dat<br>ALL_POTENTIALS     BASIS_LRIGPW_AUXMOLOPT  BASIS_RI_cc-TZ  dftd3.dat        GTH_POTENTIALS  NLCC_POTENTIALS      rVV10_kernel_table.dat  xc_section<br>BASIS_ADMM         BASIS_MOLOPT            BASIS_SET       ECP_POTENTIALS   HF_POTENTIALS   nm12_parameters.xml  t_c_g.dat<br>BASIS_ADMM_MOLOPT  BASIS_MOLOPT_UCL        BASIS_ZIJLSTRA  EMSL_BASIS_SETS  HFX_BASIS       POTENTIAL            t_sh_p_s_c.dat<br></div><div><br></div><div><br></div><div>please check my input<br></div><br>On Sunday, 9 August 2020 18:48:31 UTC+5:30, Atish Ghosh  wrote:<blockquote class="gmail_quote" style="margin: 0;margin-left: 0.8ex;border-left: 1px #ccc solid;padding-left: 1ex;"><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> *****************************<wbr>******************************<wbr>********************<br> *   ___                           <wbr>                              <wbr>              *<br> *  /   \                             <wbr>                              <wbr>           *<br> * [ABORT]                       <wbr>                              <wbr>                *<br> *  \___/    The requested basis set <DZVP-GTH-PADE> for element <SE> was not  *<br> *    |                 found in the basis set files <./BASIS_SET>             *<br> *  O/|                           <wbr>                              <wbr>               *<br> * /| |                             <wbr>                              <wbr>             *<br> * / \                             <wbr>             aobasis/basis_set_types.F:1536 *<br> *****************************<wbr>******************************<wbr>********************<br><br>Please help me in this aspect.<br></div></div></blockquote></div>