{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0317926 0.0463887 1.270674 ] [ 0.0111454 2.887791 2.968384 ] [ 2.5478 0.1715431 0.0845133 ] [ 1.93577 0.0052704 2.481441 ] [ 2.875434 2.93696 0.1676441 ] [ 2.282488 2.689422 2.770272 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.17926e-12 4.63887e-12 1.270674e-10 ] [ 1.11454e-12 2.887791e-10 2.968384e-10 ] [ 2.5478e-10 1.715431e-11 8.451330000000001e-12 ] [ 1.93577e-10 5.270399999999999e-13 2.481441e-10 ] [ 2.875434e-10 2.93696e-10 1.676441e-11 ] [ 2.282488e-10 2.689422e-10 2.770272e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1621137 0.7545513 -0.2107375 ] [ -0.1586893 -0.7131635 -0.5092955 ] [ -0.5815583 2.8289584 1.1863052 ] [ 1.1057014 2.8139117 -0.2134908 ] [ -0.9478048 -3.1953022 2.3863076 ] [ 0.4202374 -2.4889557 -2.6390891 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.597347821912857e-10 1.208924462014324e-09 -3.37638698407575e-10 ] [ -2.542482885258162e-10 -1.142613895921659e-09 -8.15981349901347e-10 ] [ -9.317591195687621e-10 4.532491047038025e-09 1.900670472232697e-09 ] [ 1.771528947261087e-09 4.508383575879217e-09 -3.420499713339672e-10 ] [ -1.518550704153043e-09 -5.119438523408795e-09 3.823286278256618e-09 ] [ 6.732945430129115e-10 -3.987746665601113e-09 -4.228286891064089e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.76241171922761 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.884546121603424e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.0957353 0.3961086 1.5064848 ] [ -0.04009 2.4672159 2.5070661 ] [ 2.1286853 0.4933204 0.1235017 ] [ 2.2724292 0.2383588 2.5059673 ] [ 2.9722449 2.611286 0.457769 ] [ 2.2554254 2.5310855 2.6421395 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.57353e-12 3.961086e-11 1.5064848e-10 ] [ -4.009e-12 2.4672159e-10 2.5070661e-10 ] [ 2.1286853e-10 4.933204e-11 1.235017e-11 ] [ 2.2724292e-10 2.383588e-11 2.5059673e-10 ] [ 2.9722449e-10 2.611286e-10 4.57769e-11 ] [ 2.2554254e-10 2.5310855e-10 2.6421395e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.02e-05 -2.48e-05 2e-06 ] [ -7.13e-05 6.33e-05 -6.5e-06 ] [ 3.2e-06 1.16e-05 -4.03e-05 ] [ 4.21e-05 -3.68e-05 5.83e-05 ] [ -8e-07 2.36e-05 -1.06e-05 ] [ 3.7e-05 -3.69e-05 -2.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.63422016668e-14 -3.97339805232e-14 3.204353268e-15 ] [ -1.142351940042e-13 1.014177809322e-13 -1.0414148121e-14 ] [ 5.1269652288e-15 1.85852489544e-14 -6.456771835019998e-14 ] [ 6.745163629139998e-14 -5.896010013119999e-14 9.34068977622e-14 ] [ -1.2817413072e-15 3.78113685624e-14 -1.69830723204e-14 ] [ 5.9280535458e-14 -5.91203177946e-14 -4.6463122386e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.065364719227606 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.573955196983444e-18 } }