src/gromacs/ewald/tests/refdata/Pme_SplineAndSpreadTest_WorksWith_box_tric_order_3_grid_16_12_14_system_1_atom.xml

   1 <?xml version="1.0"?>
   2 <?xml-stylesheet type="text/xsl" href="referencedata.xsl"?>
   3 <ReferenceData>
   4   <Splines Name="Values">
   5     <Sequence Name="X">
   6       <Int Name="Length">3</Int>
   7       <Real>0.35769526137043567</Real>
   8       <Real>0.63041709293829207</Real>
   9       <Real>0.011887645691272288</Real>
  10     </Sequence>
  11     <Sequence Name="Y">
  12       <Int Name="Length">3</Int>
  13       <Real>0.099485422038718782</Real>
  14       <Real>0.74709063607685411</Real>
  15       <Real>0.1534239418844271</Real>
  16     </Sequence>
  17     <Sequence Name="Z">
  18       <Int Name="Length">3</Int>
  19       <Real>0.41390083004880668</Real>
  20       <Real>0.58203440211228463</Real>
  21       <Real>0.0040647678389086929</Real>
  22     </Sequence>
  23   </Splines>
  24   <Splines Name="Derivatives">
  25     <Sequence Name="X">
  26       <Int Name="Length">3</Int>
  27       <Real>-0.8458076156791634</Real>
  28       <Real>0.69161523135832681</Real>
  29       <Real>0.1541923843208366</Real>
  30     </Sequence>
  31     <Sequence Name="Y">
  32       <Int Name="Length">3</Int>
  33       <Real>-0.4460614801542917</Real>
  34       <Real>-0.1078770396914166</Real>
  35       <Real>0.5539385198457083</Real>
  36     </Sequence>
  37     <Sequence Name="Z">
  38       <Int Name="Length">3</Int>
  39       <Real>-0.90983606220989799</Real>
  40       <Real>0.81967212441979598</Real>
  41       <Real>0.090163937790102011</Real>
  42     </Sequence>
  43   </Splines>
  44   <Sequence Name="Gridline indices">
  45     <Int Name="Length">1</Int>
  46     <Vector>
  47       <Int Name="X">12</Int>
  48       <Int Name="Y">3</Int>
  49       <Int Name="Z">1</Int>
  50     </Vector>
  51   </Sequence>
  52   <NonZeroGridValues Name="RealSpaceGrid">
  53     <Real Name="Cell 12 3 1">0.072907820051953801</Real>
  54     <Real Name="Cell 12 3 2">0.1025242192634528</Real>
  55     <Real Name="Cell 12 3 3">0.0007160008887084824</Real>
  56     <Real Name="Cell 12 4 1">0.54750483579787468</Real>
  57     <Real Name="Cell 12 4 2">0.76991063226334622</Real>
  58     <Real Name="Cell 12 4 3">0.0053768436461839415</Real>
  59     <Real Name="Cell 12 5 1">0.1124366255612588</Real>
  60     <Real Name="Cell 12 5 2">0.15811029933511669</Real>
  61     <Real Name="Cell 12 5 3">0.0011041987508044659</Real>
  62     <Real Name="Cell 13 3 1">0.12849579218222132</Real>
  63     <Real Name="Cell 13 3 2">0.18069297316437982</Real>
  64     <Real Name="Cell 13 3 3">0.0012619099203927632</Real>
  65     <Real Name="Cell 13 4 1">0.96494542765525437</Real>
  66     <Real Name="Cell 13 4 2">1.3569227077657271</Real>
  67     <Real Name="Cell 13 4 3">0.009476374184058927</Real>
  68     <Real Name="Cell 13 5 1">0.1981630127124144</Real>
  69     <Real Name="Cell 13 5 2">0.27866020614464265</Real>
  70     <Real Name="Cell 13 5 3">0.0019460860729361054</Real>
  71     <Real Name="Cell 14 3 1">0.0024230187718452647</Real>
  72     <Real Name="Cell 14 3 2">0.0034072902970779312</Real>
  73     <Real Name="Cell 14 3 3">2.379557628745825e-05</Real>
  74     <Real Name="Cell 14 4 1">0.01819577781737226</Real>
  75     <Real Name="Cell 14 4 2">0.025587212911975576</Real>
  76     <Real Name="Cell 14 4 3">0.00017869404240446077</Real>
  77     <Real Name="Cell 14 5 1">0.0037367192460799189</Real>
  78     <Real Name="Cell 14 5 2">0.0052546382958379937</Real>
  79     <Real Name="Cell 14 5 3">3.6696945528487431e-05</Real>
  80   </NonZeroGridValues>
  81 </ReferenceData>