{ "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" [ [ 1.1028 0.2583089 1.436622 ] [ 0.0542075 1.282802 2.764068 ] [ 0.3917807 2.567162 0.7355983 ] [ 2.495357 1.268739 0.0869323 ] [ 2.96001 0.2024969 2.578704 ] [ 2.541972 2.542294 2.28683 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1028e-10 2.583089e-11 1.436622e-10 ] [ 5.42075e-12 1.282802e-10 2.764068e-10 ] [ 3.917807e-11 2.567162e-10 7.355983000000001e-11 ] [ 2.495357e-10 1.268739e-10 8.693230000000001e-12 ] [ 2.96001e-10 2.024969e-11 2.578704e-10 ] [ 2.541972e-10 2.542294e-10 2.28683e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.5252376 -34.0136614 -16.4613904 ] [ -16.5021414 19.3237195 17.8814761 ] [ -6.6847917 9.7270395 -0.0510951 ] [ 8.5869017 4.0367353 -9.9241963 ] [ 9.1287476 -4.2778012 6.3214494 ] [ 0.9460462 5.2039684 2.2337563 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.250229946018237e-09 -5.449589353186772e-08 -2.637405506203191e-08 ] [ -2.643934536204404e-08 3.096001186487016e-08 2.864928318884944e-08 ] [ -1.071021706489714e-08 1.558443540489504e-08 -8.186337533189339e-11 ] [ 1.375773326219488e-08 6.467562975302979e-09 -1.590031542308925e-08 ] [ 1.462586610240358e-08 -6.85379312753716e-09 1.012807852169332e-08 ] [ 1.515733116324491e-09 8.337676574554364e-09 3.578872149910294e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.2080745 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.315078517403123e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0871881 -0.0507544 1.2609539 ] [ 0.0395468 1.604321 3.0559075 ] [ 0.2553247 2.5498998 0.5710729 ] [ 2.6198771 1.5710074 -0.1810732 ] [ 3.089067 0.0119692 2.8560846 ] [ 2.4551234 2.4353597 2.3258089 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0871881e-10 -5.07544e-12 1.2609539e-10 ] [ 3.95468e-12 1.604321e-10 3.0559075e-10 ] [ 2.553247e-11 2.5498998e-10 5.710729e-11 ] [ 2.6198771e-10 1.5710074e-10 -1.810732e-11 ] [ 3.089067e-10 1.19692e-12 2.8560846e-10 ] [ 2.4551234e-10 2.4353597e-10 2.3258089e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.6e-06 -1.3e-06 -3.4e-06 ] [ -9.6e-06 5e-07 -4e-07 ] [ -1.01e-05 4e-07 8.5e-06 ] [ 1.05e-05 1.6e-06 8.8e-06 ] [ 2.4e-06 1.6e-06 1.7e-06 ] [ 1.04e-05 -2.8e-06 -1.51e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.767835882399999e-15 -2.0828296242e-15 -5.4474005556e-15 ] [ -1.53808956864e-14 8.010883169999999e-16 -6.408706536e-16 ] [ -1.61819840034e-14 6.408706536e-16 1.3618501389e-14 ] [ 1.6822854657e-14 2.5634826144e-15 1.40991543792e-14 ] [ 3.845223921599999e-15 2.5634826144e-15 2.7237002778e-15 ] [ 1.66626369936e-14 -4.486094575199999e-15 -2.41928671734e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.570354 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.135516389790843e-18 } }