{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.1688 2.788884 1.320769 ] [ 2.532136 2.630615 3.81334 ] [ 3.448306 1.022917 2.319133 ] [ 4.871015 2.854538 3.444822 ] [ 3.148673 5.011898 0.914954 ] [ 4.462028 3.106005 1.382629 ] [ 3.536809 5.003724 3.350012 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1688e-10 2.788884e-10 1.320769e-10 ] [ 2.532136e-10 2.630615e-10 3.813340000000001e-10 ] [ 3.448306e-10 1.022917e-10 2.319133e-10 ] [ 4.871015e-10 2.854538e-10 3.444822e-10 ] [ 3.148673e-10 5.011898e-10 9.149540000000001e-11 ] [ 4.462028e-10 3.106005e-10 1.382629e-10 ] [ 3.536809e-10 5.003724e-10 3.350012e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.5964714 0.1832317 -2.5400824 ] [ -4.0984067 0.6967198 4.7016905 ] [ -0.6758169 -7.95569 -0.5540519 ] [ 4.5737688 1.5197617 4.0378269 ] [ -0.4330766 2.3742527 0.2681576 ] [ 7.2191685 0.4524028 -7.1807053 ] [ -0.9891656 2.7293212 1.2671646 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.966535636055846e-09 2.935695459294394e-10 -4.069660636185554e-09 ] [ -6.566371397270079e-09 1.116268174808452e-09 7.532938597337462e-09 ] [ -1.082778037121532e-09 -1.274642052033235e-08 -8.876890008898196e-10 ] [ 7.32798544030447e-09 2.434926664927263e-09 6.469311858017339e-09 ] [ -6.938652035355532e-10 3.803972167811276e-09 4.29635837409838e-10 ] [ 1.156638299231581e-08 7.248291893444582e-10 -1.150475815251465e-08 ] [ -1.584817998419605e-09 4.372854617293801e-09 2.030221496825384e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.0337125 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.447360296652872e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7576393 2.632502 1.6917006 ] [ 1.7831751 3.2357243 3.9002143 ] [ 3.4734508 1.142401 1.4130036 ] [ 5.4145539 3.4703662 3.4717033 ] [ 3.2423849 4.381904 1.2283515 ] [ 5.0037634 2.8422101 1.3086573 ] [ 3.4927995 4.7134735 3.5320286 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7576393e-10 2.632502e-10 1.6917006e-10 ] [ 1.7831751e-10 3.2357243e-10 3.9002143e-10 ] [ 3.4734508e-10 1.142401e-10 1.4130036e-10 ] [ 5.414553899999999e-10 3.4703662e-10 3.4717033e-10 ] [ 3.2423849e-10 4.381904e-10 1.2283515e-10 ] [ 5.0037634e-10 2.8422101e-10 1.3086573e-10 ] [ 3.4927995e-10 4.7134735e-10 3.5320286e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.66e-05 -1.25e-05 -4.4e-06 ] [ 2.36e-05 6.94e-05 1.84e-05 ] [ 1.17e-05 1.03e-05 -3.48e-05 ] [ -1.84e-05 -7.2e-06 -1.04e-05 ] [ -2.54e-05 -1.86e-05 1.59e-05 ] [ 6.8e-06 -4.8e-06 1.76e-05 ] [ -2.49e-05 -3.66e-05 -2.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.261789811328e-14 -2.002720776e-14 -7.04957713152e-15 ] [ 3.781136825088e-14 1.1119105748352e-13 2.948004982272e-14 ] [ 1.874546646336e-14 1.650241919424e-14 -5.575574640383999e-14 ] [ -2.948004982272e-14 -1.153567166976e-14 -1.666263685632e-14 ] [ -4.069528616832e-14 -2.980048514688e-14 2.547460827072e-14 ] [ 1.089480102144e-14 -7.69044777984e-15 2.819830852608e-14 ] [ -3.989419785791999e-14 -5.863966432128e-14 -3.84522388992e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.403283 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.307660328536609e-18 } }