{ "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" [ [ 0.2482594 0.208506 0.7144033 ] [ 0.1842271 0.5542422 2.415306 ] [ 0.3347056 2.949491 0.3757933 ] [ 2.042519 0.2544893 1.784175 ] [ 2.203059 1.053322 2.694572 ] [ 1.978392 2.822156 1.26577 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.482594e-11 2.08506e-11 7.144033e-11 ] [ 1.842271e-11 5.542422e-11 2.415306e-10 ] [ 3.347056e-11 2.949491e-10 3.757933e-11 ] [ 2.042519e-10 2.544893e-11 1.784175e-10 ] [ 2.203059e-10 1.053322e-10 2.694572e-10 ] [ 1.978392e-10 2.822156e-10 1.26577e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -18.8658645 -13.8747009 -13.2538211 ] [ -29.2460968 -8.6250617 9.8526398 ] [ -13.8225076 17.2873274 -14.0693591 ] [ 107.4532072 388.6333692 463.8356841 ] [ -60.1243021 -408.0021117 -441.7238754 ] [ 14.6055638 24.5811777 -4.6412682 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.022644703308068e-08 -2.222972140257272e-08 -2.123496230268574e-08 ] [ -4.685741254261369e-08 -1.38188722086975e-08 1.578566914072359e-08 ] [ -2.214609851755032e-08 2.769735179639525e-08 -2.254159821965973e-08 ] [ 1.721590164058182e-07 6.226592981949748e-07 7.431466889577942e-07 ] [ -9.632975116653634e-08 -6.536914446027702e-07 -7.077196660150523e-07 ] [ 2.340069285396281e-08 3.938338822267032e-08 -7.436131400902498e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 246.77285 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.953736909181853e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.230001 0.1950647 0.7015566 ] [ 0.155905 0.5458935 2.424852 ] [ 0.3213201 2.9662265 0.3621708 ] [ 2.1457008 0.6445296 2.2500794 ] [ 2.1457008 0.6445296 2.2500794 ] [ 1.9925343 2.8459626 1.2612813 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.30001e-11 1.950647e-11 7.015566e-11 ] [ 1.55905e-11 5.458935000000001e-11 2.424852e-10 ] [ 3.213201e-11 2.9662265e-10 3.621708e-11 ] [ 2.1457008e-10 6.445296000000001e-11 2.2500794e-10 ] [ 2.1457008e-10 6.445296000000001e-11 2.2500794e-10 ] [ 1.9925343e-10 2.8459626e-10 1.2612813e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -17.1064815 -15.2583087 -16.043892 ] [ -30.7480254 -8.0478053 11.9872687 ] [ -14.6659143 17.0441062 -14.4182139 ] [ 8.662428111166117e+110 2.1656070277915293e+110 11.0439824 ] [ -8.662428111166117e+110 -2.1656070277915293e+110 11.0439824 ] [ 15.23363 25.7318227 -3.6131276 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.740760472344772e-08 -2.444650547208925e-08 -2.570514866904015e-08 ] [ -4.926376743164457e-08 -1.289400550041033e-08 1.920572165838761e-08 ] [ -2.34973850141164e-08 2.730766847607233e-08 -2.310052522427359e-08 ] [ 1.387873979907106e+102 3.469684949767764e+101 1.769441040180668e-08 ] [ -1.387873979907106e+102 -3.469684949767764e+101 1.769441040180668e-08 ] [ 2.44069658359175e-08 4.122692474051073e-08 -5.788868568687214e-09 ] ] } "relaxed-potential-energy" { "source-value" -6.8122026e+94 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.091435174187298e+76 } }