src/gromacs/listed_forces/tests/refdata/Angle_ListedForcesTest_Ifunc_61.xml

   1 <?xml version="1.0"?>
   2 <?xml-stylesheet type="text/xsl" href="referencedata.xsl"?>
   3 <ReferenceData>
   4   <FunctionType Name="CROSS_BOND_BOND">
   5     <FEP Name="No">
   6       <Real Name="Epot ">31.630464766109874</Real>
   7       <Real Name="dVdlambda ">0</Real>
   8       <Vector Name="Central shift forces">
   9         <Real Name="X">3.5527136788005009e-15</Real>
  10         <Real Name="Y">3.5527136788005009e-15</Real>
  11         <Real Name="Z">0</Real>
  12       </Vector>
  13       <Sequence Name="Forces">
  14         <Int Name="Length">4</Int>
  15         <Vector>
  16           <Real Name="X">-21.67688664800416</Real>
  17           <Real Name="Y">-13.57887212595886</Real>
  18           <Real Name="Z">0</Real>
  19         </Vector>
  20         <Vector>
  21           <Real Name="X">-24.97211920885367</Real>
  22           <Real Name="Y">36.096366936188971</Real>
  23           <Real Name="Z">0</Real>
  24         </Vector>
  25         <Vector>
  26           <Real Name="X">66.04284820142226</Real>
  27           <Real Name="Y">-45.509035444800681</Real>
  28           <Real Name="Z">0</Real>
  29         </Vector>
  30         <Vector>
  31           <Real Name="X">-19.393842344564419</Real>
  32           <Real Name="Y">22.991540634570573</Real>
  33           <Real Name="Z">0</Real>
  34         </Vector>
  35       </Sequence>
  36     </FEP>
  37   </FunctionType>
  38 </ReferenceData>