src/gromacs/listed_forces/tests/refdata/Angle_ListedForcesTest_Ifunc_14.xml

   1 <?xml version="1.0"?>
   2 <?xml-stylesheet type="text/xsl" href="referencedata.xsl"?>
   3 <ReferenceData>
   4   <FunctionType Name="LINEAR_ANGLES">
   5     <FEP Name="No">
   6       <Real Name="Epot ">0.40544900000000034</Real>
   7       <Real Name="dVdlambda ">0</Real>
   8       <Sequence Name="Forces">
   9         <Int Name="Length">4</Int>
  10         <Vector>
  11           <Real Name="X">-0.94000000000000128</Real>
  12           <Real Name="Y">1.532</Real>
  13           <Real Name="Z">0.10800000000000157</Real>
  14         </Vector>
  15         <Vector>
  16           <Real Name="X">3.6740000000000039</Real>
  17           <Real Name="Y">-4.7460000000000013</Real>
  18           <Real Name="Z">-1.078000000000003</Real>
  19         </Vector>
  20         <Vector>
  21           <Real Name="X">-4.7200000000000042</Real>
  22           <Real Name="Y">4.5880000000000036</Real>
  23           <Real Name="Z">2.1819999999999995</Real>
  24         </Vector>
  25         <Vector>
  26           <Real Name="X">1.9860000000000011</Real>
  27           <Real Name="Y">-1.3740000000000021</Real>
  28           <Real Name="Z">-1.2119999999999984</Real>
  29         </Vector>
  30       </Sequence>
  31       <Shift-Forces Name="Shift-forces">
  32         <Vector Name="Central">
  33           <Real Name="X">0</Real>
  34           <Real Name="Y">2.2204460492503131e-16</Real>
  35           <Real Name="Z">0</Real>
  36         </Vector>
  37       </Shift-Forces>
  38     </FEP>
  39   </FunctionType>
  40 </ReferenceData>