{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.8122893e-10 1.5256909e-10 2.7998315e-10 ] [ 3.6834118e-10 1.340242e-11 1.8977375e-10 ] [ 4.08602e-10 2.5246429e-10 2.509925e-10 ] ] "source-value" [ [ 1.8122893 1.5256909 2.7998315 ] [ 3.6834118 0.1340242 1.8977375 ] [ 4.08602 2.5246429 2.509925 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 4.864208220748801e-13 1.209643348704e-13 -8.988210842688002e-14 ] [ 2.899939683648e-14 6.958253064134401e-13 2.010731659104e-13 ] [ -5.154202189113601e-13 -8.167896412838402e-13 -1.1119105748352e-13 ] ] "source-value" [ [ 0.0003036 7.55e-05 -5.61e-05 ] [ 1.81e-05 0.0004343 0.0001255 ] [ -0.0003217 -0.0005098 -6.94e-05 ] ] } "species" { "source-value" [ "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -7.704444555016972e-19 "source-value" -4.8087361 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -9.550193037900062e-09 -4.452258009967663e-09 1.140815122815729e-09 ] [ -1.087390703612815e-09 1.028779077382399e-09 5.901928404981236e-10 ] [ 1.063758374151288e-08 3.423478772367602e-09 -1.731007963313852e-09 ] ] "source-value" [ [ -5.9607617 -2.7788809 0.7120408 ] [ -0.6786959 0.6421134 0.3683694 ] [ 6.6394576 2.1367674 -1.0804102 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.39384695608145e-19 "source-value" -3.3665745 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.89741e-10 1.753889e-10 2.846167e-10 ] [ 3.867988e-10 4.330001e-12 1.822705e-10 ] [ 3.816323e-10 2.387169e-10 2.538622e-10 ] ] "source-value" [ [ 1.89741 1.753889 2.846167 ] [ 3.867988 0.04330001 1.822705 ] [ 3.816323 2.387169 2.538622 ] ] } "instance-id" 1 }