{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.376748 2.356906 1.723048 ] [ 1.891208 1.427855 3.861744 ] [ 2.621896 4.609245 2.418974 ] [ 4.560356 2.199202 1.122098 ] [ 4.097908 2.987714 3.135416 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.376748e-10 2.356906e-10 1.723048e-10 ] [ 1.891208e-10 1.427855e-10 3.861744e-10 ] [ 2.621896e-10 4.609245e-10 2.418974e-10 ] [ 4.560356e-10 2.199202e-10 1.122098e-10 ] [ 4.097908e-10 2.987714e-10 3.135416e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.9986007 -0.4069889 -0.8744677 ] [ 2.6148701 1.5024687 -0.8007392 ] [ -0.7188869 1.2175183 -0.1574172 ] [ 2.1204348 -1.3253311 -2.4308196 ] [ -1.0178173 -0.987667 4.2634438 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.804287976236043e-09 -6.520681058773625e-10 -1.401051716127722e-09 ] [ 4.189483775165243e-09 2.407220244456355e-09 -1.282925636167853e-09 ] [ -1.151783793668695e-09 1.950679371727402e-09 -2.522101596297048e-10 ] [ 3.397311090480463e-09 -2.123414520733517e-09 -3.894602364589226e-09 ] [ -1.630723095740968e-09 -1.582416989572878e-09 6.830790036732169e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.654212 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.027428278808241e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2493995 2.4663275 1.6126091 ] [ 2.1872479 1.4187317 3.7833224 ] [ 2.5677887 4.7188346 2.4114551 ] [ 4.5738217 2.0110026 1.1619973 ] [ 3.9698583 2.9660256 3.2918961 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2493995e-10 2.4663275e-10 1.6126091e-10 ] [ 2.1872479e-10 1.4187317e-10 3.7833224e-10 ] [ 2.5677887e-10 4.7188346e-10 2.4114551e-10 ] [ 4.5738217e-10 2.0110026e-10 1.1619973e-10 ] [ 3.9698583e-10 2.9660256e-10 3.2918961e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.7e-06 9.9e-06 1.34e-05 ] [ 2.89e-05 -3.6e-06 -2.59e-05 ] [ 1.03e-05 -4e-06 -8.8e-06 ] [ -1.43e-05 -8.4e-06 1.58e-05 ] [ -1.93e-05 6e-06 5.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.1324068138e-15 1.58615486766e-14 2.14691668956e-14 ] [ 4.63029047226e-14 -5.767835882399999e-15 -4.149637482059999e-14 ] [ 1.65024193302e-14 -6.408706535999999e-15 -1.40991543792e-14 ] [ -2.29111258662e-14 -1.34582837256e-14 2.53143908172e-14 ] [ -3.09220090362e-14 9.613059803999999e-15 8.811971486999999e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.621881 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.182465944932855e-18 } }