<div dir="ltr">Dear all,<div><br></div><div>I am trying to run a LT-DF-LCC2 calculation but got the error message below. Another user posted about the same problem in July 2013 but I couldn't find any reply (see "LT-DF-LCC2 - basis set problem").</div><div><br></div><div>Orbital-basis loaded. Number of functions:             24<br></div><div>DF-basis CC-PVDZ/MP2FIT       loaded. Number of functions:      84<br></div><div>CPU time for DF-2ext transformation (total)      0.02 sec<br></div><div>? Error<br></div><div>? empty file to sort<br></div><div>? The problem occurs in init__blkbinsrt<br></div><div>GLOBAL ERROR fehler on processor   0<br></div><div><br></div><div><br></div><div>My input file is:</div><div><br></div><div>memory,<span class="">50</span>,m<br></div><div>angstrom</div><div>symmetry, nosym</div><div>geomtyp=xyz</div><div>geometry={</div><div>3</div><div>h2o</div><div>O                 -<span class="">0</span><span class="">.</span><span class="">09259259</span>    <span class="">0</span><span class="">.</span><span class="">04629630</span>    <span class="">0</span><span class="">.</span><span class="">00000000</span><br></div><div><span class="">H                  <span class="">0</span><span class="">.</span><span class="">86740741</span>    <span class="">0</span><span class="">.</span><span class="">04629630</span>    <span class="">0</span><span class="">.</span><span class="">00000000</span><br></span></div><div><span class=""><span class="">H                 -<span class="">0</span><span class="">.</span><span class="">41304717</span>    <span class="">0</span><span class="">.</span><span class="">95123213</span>    <span class="">0</span><span class="">.</span><span class="">00000000</span></span></span></div><div>}</div><div>basis<span class="">=</span>{<br></div><div>default,vdz<br></div><div><span class="">set</span>,mp2fit<br></div><div>default,vdz<span class="">/</span>mp2fit<br></div><div><span class="">set</span>,jkfit<br></div><div>default,vdz<span class="">/</span>jkfit }<br></div><div>hf<br></div><div>{lt-df-lcc2  <br></div><div>eom,-<span class="">4</span><span class="">.</span><span class="">1</span>  <br></div><div>}</div><div><br></div></div>