{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.101107 2.382088 1.155059 ] [ 1.870329 4.675053 0.5879216 ] [ 2.558831 4.133121 3.113399 ] [ 4.446179 2.802067 2.809564 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.101107e-10 2.382088e-10 1.155059e-10 ] [ 1.870329e-10 4.675053e-10 5.879216e-11 ] [ 2.558831e-10 4.133121e-10 3.113399e-10 ] [ 4.446179e-10 2.802067e-10 2.809564e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9900206 -0.3625597 1.1497565 ] [ -0.0527864 0.7983903 0.4736701 ] [ -0.7728365 0.1785776 -1.1449021 ] [ -0.1643977 -0.6144082 -0.4785245 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.58618787249866e-09 -5.808846797700497e-10 1.842112999089621e-09 ] [ -8.457313667297758e-11 1.27916228347225e-09 7.589031664444432e-10 ] [ -1.238220582202341e-09 2.861128580757984e-10 -1.834335392837531e-09 ] [ -2.633941536233418e-10 -9.843904617779986e-10 -7.66680772696533e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -6.5889313 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.055663177189124e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.653892 2.2590731 0.7809855 ] [ 1.6472274 4.4029984 1.0162298 ] [ 2.8343035 4.7370756 3.052005 ] [ 3.8410231 2.5931819 2.8167233 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.653892e-10 2.2590731e-10 7.809855e-11 ] [ 1.6472274e-10 4.402998400000001e-10 1.0162298e-10 ] [ 2.8343035e-10 4.7370756e-10 3.052005e-10 ] [ 3.841023100000001e-10 2.5931819e-10 2.8167233e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.35e-05 4.84e-05 3.09e-05 ] [ -9.4e-06 -1.26e-05 3.4e-05 ] [ 5.7e-06 -1.38e-05 -6.09e-05 ] [ -2.98e-05 -2.21e-05 -4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.367291723899999e-14 7.754534908559998e-14 4.950725799059999e-14 ] [ -1.50604603596e-14 -2.01874255884e-14 5.447400555599999e-14 ] [ 9.1324068138e-15 -2.21100375492e-14 -9.757255701059999e-14 ] [ -4.77448636932e-14 -3.54081036114e-14 -6.408706535999999e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.6375609 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.383889824873201e-18 } }