src/gromacs/ewald/tests/refdata/PmeDiffEwaldQ_SolveTest_WorksWith_box_rect_grid_9_7_23_gridvalues_second_eps_1_2_ewaldq_0_4_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">2.7045303357990856e-21</Real>
   6   </NonZeroGridValues>
   7   <Real Name="Energy">4.0567956649011983e-22</Real>
   8   <Matrix Name="Virial">
   9     <Real Name="Cell 0 0">-2.0283978324505992e-22</Real>
  10     <Real Name="Cell 1 0">0</Real>
  11     <Real Name="Cell 1 1">1.9685468185198564e-20</Real>
  12     <Real Name="Cell 2 0">0</Real>
  13     <Real Name="Cell 2 1">0</Real>
  14     <Real Name="Cell 2 2">-2.0283978324505992e-22</Real>
  15   </Matrix>
  16 </ReferenceData>