src/gromacs/ewald/tests/refdata/DifferentEpsilonR_PmeSolveTest_ReproducesOutputs_3.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">-5.4292848213686879e-16</Real>
   6   </NonZeroGridValues>
   7   <Real Name="Energy">-8.1439275556636247e-17</Real>
   8   <Matrix Name="Virial">
   9     <Real Name="Cell 0 0">4.0719637778318123e-17</Real>
  10     <Real Name="Cell 1 0">-2.215406351573413e-112</Real>
  11     <Real Name="Cell 1 1">-2.3047772408403365e-15</Real>
  12     <Real Name="Cell 2 0">-1.3181668161597632e-111</Real>
  13     <Real Name="Cell 2 1">-1.5507844461013891e-111</Real>
  14     <Real Name="Cell 2 2">4.0719637778318123e-17</Real>
  15   </Matrix>
  16 </ReferenceData>