src/gromacs/ewald/tests/refdata/PmeDiffEps_SolveTest_WorksWith_box_rect_grid_9_7_23_gridvalues_second_eps_1_9_ewaldq_2_ewaldlj_0_7_method_Coulomb.xml

   1 <?xml version="1.0"?>
   2 <?xml-stylesheet type="text/xsl" href="referencedata.xsl"?>
   3 <ReferenceData>
   4   <NonZeroGridValues Name="ComplexSpaceGrid">
   5     <Real Name="Cell 0 4 0 im">0.17992679221158031</Real>
   6     <Real Name="Cell 0 6 7 re">3.1968338295728969e-14</Real>
   7     <Real Name="Cell 2 5 10 re">1.4964328914799362e-27</Real>
   8     <Real Name="Cell 2 5 10 im">4.426947262667796e-27</Real>
   9     <Real Name="Cell 4 2 7 re">5.8210622743705147e-13</Real>
  10     <Real Name="Cell 4 2 7 im">-1.6921692376580856e-12</Real>
  11   </NonZeroGridValues>
  12   <Real Name="Energy">0.026989019979995935</Real>
  13   <Matrix Name="Virial">
  14     <Real Name="Cell 0 0">-0.013494509941831379</Real>
  15     <Real Name="Cell 1 0">5.6666575176370801e-11</Real>
  16     <Real Name="Cell 1 1">0.065340063877066978</Real>
  17     <Real Name="Cell 2 0">3.3716613175666156e-10</Real>
  18     <Real Name="Cell 2 1">3.9636410774125401e-10</Real>
  19     <Real Name="Cell 2 2">-0.013494507626242217</Real>
  20   </Matrix>
  21 </ReferenceData>