{ "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" [ [ 2.060429 2.678734 2.453953 ] [ 2.544795 1.257014 4.108114 ] [ 3.849483 1.551428 2.063601 ] [ 4.178567 2.654376 4.014408 ] [ 4.257126 3.923601 2.295059 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.060429e-10 2.678734e-10 2.453953e-10 ] [ 2.544795e-10 1.257014e-10 4.108114e-10 ] [ 3.849483e-10 1.551428e-10 2.063601e-10 ] [ 4.178567e-10 2.654376e-10 4.014408000000001e-10 ] [ 4.257126000000001e-10 3.923601e-10 2.295059e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.2554489 6.137254 -2.3647774 ] [ -4.5895293 -7.0700103 4.8674457 ] [ 5.7866335 -7.5455824 -6.7990717 ] [ 5.737433 2.4706085 9.4087032 ] [ 1.3209116 6.0077303 -5.1122998 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.3226687330761e-08 9.832964955723035e-09 -3.788791094891271e-09 ] [ -7.353236605518375e-09 -1.132740530479933e-08 7.798507767803773e-09 ] [ 9.271208983221637e-09 -1.208935581120164e-08 -1.089331381063066e-08 ] [ 9.192381091740522e-09 3.958351210461788e-09 1.507440442328103e-08 ] [ 2.116333701099554e-09 9.62544511003381e-09 -8.190807285562871e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.3823574 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.021310628116991e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.7849494 2.793656 2.155021 ] [ 2.4274726 1.3401859 4.1361187 ] [ 4.011196 1.3786836 2.0228013 ] [ 4.654661 2.5495619 4.3011331 ] [ 4.012121 4.0030656 2.3200609 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7849494e-10 2.793656e-10 2.155021e-10 ] [ 2.4274726e-10 1.3401859e-10 4.1361187e-10 ] [ 4.011196e-10 1.3786836e-10 2.0228013e-10 ] [ 4.654661e-10 2.5495619e-10 4.3011331e-10 ] [ 4.012121e-10 4.0030656e-10 2.3200609e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.16e-05 2.2e-05 -4e-06 ] [ 6e-06 -2.97e-05 2.55e-05 ] [ -6.6e-06 -1.25e-05 3.6e-06 ] [ -2.18e-05 -4.9e-06 -6.2e-06 ] [ -9.2e-06 2.51e-05 -1.89e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.06287816344e-14 3.5247885948e-14 -6.408706535999999e-15 ] [ 9.613059803999999e-15 -4.75846460298e-14 4.0855504167e-14 ] [ -1.05743657844e-14 -2.0027207925e-14 5.767835882399999e-15 ] [ -3.492745062119999e-14 -7.850665506599998e-15 -9.9334951308e-15 ] [ -1.47400250328e-14 4.02146335134e-14 -3.02811383826e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.338031 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.656335170976765e-18 } }