<div dir="ltr">I am trying to construct the FES from the command available on the website (<span class="gmail-n" style="color:rgb(64,64,64);font-family:SFMono-Regular,Menlo,Monaco,Consolas,"Liberation Mono","Courier New",Courier,monospace;font-size:12px;box-sizing:border-box">graph</span><span class="gmail-o" style="font-family:SFMono-Regular,Menlo,Monaco,Consolas,"Liberation Mono","Courier New",Courier,monospace;font-size:12px;box-sizing:border-box;color:rgb(102,102,102)">.</span><span class="gmail-n" style="color:rgb(64,64,64);font-family:SFMono-Regular,Menlo,Monaco,Consolas,"Liberation Mono","Courier New",Courier,monospace;font-size:12px;box-sizing:border-box">psmp</span><span style="color:rgb(64,64,64);font-family:SFMono-Regular,Menlo,Monaco,Consolas,"Liberation Mono","Courier New",Courier,monospace;font-size:12px"> </span><span class="gmail-o" style="font-family:SFMono-Regular,Menlo,Monaco,Consolas,"Liberation Mono","Courier New",Courier,monospace;font-size:12px;box-sizing:border-box;color:rgb(102,102,102)">-</span><span class="gmail-n" style="color:rgb(64,64,64);font-family:SFMono-Regular,Menlo,Monaco,Consolas,"Liberation Mono","Courier New",Courier,monospace;font-size:12px;box-sizing:border-box">i</span><span style="color:rgb(64,64,64);font-family:SFMono-Regular,Menlo,Monaco,Consolas,"Liberation Mono","Courier New",Courier,monospace;font-size:12px"> </span><span class="gmail-n" style="color:rgb(64,64,64);font-family:SFMono-Regular,Menlo,Monaco,Consolas,"Liberation Mono","Courier New",Courier,monospace;font-size:12px;box-sizing:border-box">HILLS</span><span style="color:rgb(64,64,64);font-family:SFMono-Regular,Menlo,Monaco,Consolas,"Liberation Mono","Courier New",Courier,monospace;font-size:12px"> </span><span class="gmail-o" style="font-family:SFMono-Regular,Menlo,Monaco,Consolas,"Liberation Mono","Courier New",Courier,monospace;font-size:12px;box-sizing:border-box;color:rgb(102,102,102)">-</span><span class="gmail-n" style="color:rgb(64,64,64);font-family:SFMono-Regular,Menlo,Monaco,Consolas,"Liberation Mono","Courier New",Courier,monospace;font-size:12px;box-sizing:border-box">stride</span><span style="color:rgb(64,64,64);font-family:SFMono-Regular,Menlo,Monaco,Consolas,"Liberation Mono","Courier New",Courier,monospace;font-size:12px"> </span><span class="gmail-mi" style="font-family:SFMono-Regular,Menlo,Monaco,Consolas,"Liberation Mono","Courier New",Courier,monospace;font-size:12px;box-sizing:border-box;color:rgb(102,102,102)">10</span><span style="color:rgb(64,64,64);font-family:SFMono-Regular,Menlo,Monaco,Consolas,"Liberation Mono","Courier New",Courier,monospace;font-size:12px"> </span><span class="gmail-o" style="font-family:SFMono-Regular,Menlo,Monaco,Consolas,"Liberation Mono","Courier New",Courier,monospace;font-size:12px;box-sizing:border-box;color:rgb(102,102,102)">-</span><span class="gmail-n" style="color:rgb(64,64,64);font-family:SFMono-Regular,Menlo,Monaco,Consolas,"Liberation Mono","Courier New",Courier,monospace;font-size:12px;box-sizing:border-box">ndim</span><span style="color:rgb(64,64,64);font-family:SFMono-Regular,Menlo,Monaco,Consolas,"Liberation Mono","Courier New",Courier,monospace;font-size:12px"> </span><span class="gmail-mi" style="font-family:SFMono-Regular,Menlo,Monaco,Consolas,"Liberation Mono","Courier New",Courier,monospace;font-size:12px;box-sizing:border-box;color:rgb(102,102,102)">2</span><span style="color:rgb(64,64,64);font-family:SFMono-Regular,Menlo,Monaco,Consolas,"Liberation Mono","Courier New",Courier,monospace;font-size:12px"> </span><span class="gmail-o" style="font-family:SFMono-Regular,Menlo,Monaco,Consolas,"Liberation Mono","Courier New",Courier,monospace;font-size:12px;box-sizing:border-box;color:rgb(102,102,102)">-</span><span class="gmail-n" style="color:rgb(64,64,64);font-family:SFMono-Regular,Menlo,Monaco,Consolas,"Liberation Mono","Courier New",Courier,monospace;font-size:12px;box-sizing:border-box">ndw</span><span style="color:rgb(64,64,64);font-family:SFMono-Regular,Menlo,Monaco,Consolas,"Liberation Mono","Courier New",Courier,monospace;font-size:12px"> </span><span class="gmail-mi" style="font-family:SFMono-Regular,Menlo,Monaco,Consolas,"Liberation Mono","Courier New",Courier,monospace;font-size:12px;box-sizing:border-box;color:rgb(102,102,102)">1</span><span style="color:rgb(64,64,64);font-family:SFMono-Regular,Menlo,Monaco,Consolas,"Liberation Mono","Courier New",Courier,monospace;font-size:12px"> </span><span class="gmail-mi" style="font-family:SFMono-Regular,Menlo,Monaco,Consolas,"Liberation Mono","Courier New",Courier,monospace;font-size:12px;box-sizing:border-box;color:rgb(102,102,102)">2</span><span style="color:rgb(64,64,64);font-family:SFMono-Regular,Menlo,Monaco,Consolas,"Liberation Mono","Courier New",Courier,monospace;font-size:12px"> </span><span class="gmail-o" style="font-family:SFMono-Regular,Menlo,Monaco,Consolas,"Liberation Mono","Courier New",Courier,monospace;font-size:12px;box-sizing:border-box;color:rgb(102,102,102)">-</span><span class="gmail-n" style="color:rgb(64,64,64);font-family:SFMono-Regular,Menlo,Monaco,Consolas,"Liberation Mono","Courier New",Courier,monospace;font-size:12px;box-sizing:border-box">cp2k</span><span style="color:rgb(64,64,64);font-family:SFMono-Regular,Menlo,Monaco,Consolas,"Liberation Mono","Courier New",Courier,monospace;font-size:12px"> </span><span class="gmail-o" style="font-family:SFMono-Regular,Menlo,Monaco,Consolas,"Liberation Mono","Courier New",Courier,monospace;font-size:12px;box-sizing:border-box;color:rgb(102,102,102)">-</span><span class="gmail-n" style="color:rgb(64,64,64);font-family:SFMono-Regular,Menlo,Monaco,Consolas,"Liberation Mono","Courier New",Courier,monospace;font-size:12px;box-sizing:border-box">integrated_fes).</span><div><font color="#404040"><span style="font-size:12px"><font face="verdana, sans-serif">But I am getting this error</font><br></span></font><span style="color:rgb(64,64,64);font-family:SFMono-Regular,Menlo,Monaco,Consolas,"Liberation Mono","Courier New",Courier,monospace;font-size:12px"></span><div><span class="gmail-n" style="color:rgb(64,64,64);font-family:SFMono-Regular,Menlo,Monaco,Consolas,"Liberation Mono","Courier New",Courier,monospace;font-size:12px;box-sizing:border-box">[mii] Please select a module to run graph.psmp:<br>       MODULE      PARENT(S)<br>    1  cp2k/2023.1 StdEnv/2023 gcc/12.3 openmpi/4.1.5<br>    2  cp2k/9.1    StdEnv/2020 intel/2020.1.217 openmpi/4.0.3<br>    3  cp2k/8.2    StdEnv/2020 intel/2020.1.217 openmpi/4.0.3<br>    4  cp2k/9.1    StdEnv/2020 gcc/9.3.0 openmpi/4.0.3<br>    5  cp2k/8.2    StdEnv/2020 gcc/9.3.0 openmpi/4.0.3<br>Make a selection (1-5, q aborts) [1]: 1<br>[mii] loading StdEnv/2023 gcc/12.3 openmpi/4.1.5 cp2k/2023.1 ...<br><br>**********************************************************************<br>FES|  Parsing file:   <HILLS><br><br> Pattern: &METADYN not found in input file!<br> ABORT in metadyn_tools/graph_utils.F:207 Search failed!<br><br>Program received signal SIGABRT: Process abort signal.<br><br>Backtrace for this error:<br>#0  0x7fe683821b42 in ???<br>#1  0x7fe683820c35 in ???<br>#2  0x7fe679c6378f in ???<br>#3  0x7fe679cb17ac in ???<br>#4  0x7fe679c636f1 in ???<br>#5  0x7fe679c4d4b1 in ???<br>#6  0x517524 in ???<br>#7  0x517569 in ???<br>#8  0x4183a1 in ???<br>#9  0x408832 in ???<br>#10  0x4023fe in ???<br>#11  0x7fe679c4e949 in ???<br>#12  0x7fe679c4ea04 in ???<br>#13  0x402430 in ???<br>#14  0xffffffffffffffff in ???<br></span></div></div></div>

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