src/gromacs/ewald/tests/refdata/PmeDiffEwaldLJ_SolveTest_WorksWith_box_rect_grid_16_12_28_gridvalues_first_eps_1_2_ewaldq_2_ewaldlj_2_35_method_LJ.xml

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   2 <?xml-stylesheet type="text/xsl" href="referencedata.xsl"?>
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   6     <Real Name="Cell 0 0 0 im">-2.9667641307498531</Real>
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   8     <Real Name="Cell 3 1 2 im">-0.25558591442507311</Real>
   9     <Real Name="Cell 3 5 7 re">1.7720564655953271e-14</Real>
  10     <Real Name="Cell 3 5 7 im">-2.9534273990373024e-20</Real>
  11     <Real Name="Cell 6 2 4 re">-0.0028355851140043973</Real>
  12     <Real Name="Cell 6 2 4 im">-0.00023080344107898613</Real>
  13     <Real Name="Cell 7 0 0 re">0.98439186309649662</Real>
  14     <Real Name="Cell 7 0 0 im">0.27562971697307287</Real>
  15   </NonZeroGridValues>
  16   <Real Name="Energy">-16.094465920337093</Real>
  17   <Matrix Name="Virial">
  18     <Real Name="Cell 0 0">4.8742582912547263</Real>
  19     <Real Name="Cell 1 0">-0.57680403129439006</Real>
  20     <Real Name="Cell 1 1">7.5948376541956275</Real>
  21     <Real Name="Cell 2 0">-1.9611337614092448</Real>
  22     <Real Name="Cell 2 1">-1.5381440834517075</Real>
  23     <Real Name="Cell 2 2">2.8175429297438925</Real>
  24   </Matrix>
  25 </ReferenceData>