{ "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" [ [ 0.9701738 0.435353 0.8614305 ] [ 0.785215 2.880742 2.663197 ] [ 2.41347 1.4145 0.9828772 ] [ 2.657499 1.219941 2.828683 ] [ 1.63309 2.566255 0.271655 ] [ 2.657105 2.943765 2.654332 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.701738e-11 4.35353e-11 8.614305e-11 ] [ 7.85215e-11 2.880742e-10 2.663197e-10 ] [ 2.41347e-10 1.4145e-10 9.828772e-11 ] [ 2.657499e-10 1.219941e-10 2.828683e-10 ] [ 1.63309e-10 2.566255e-10 2.71655e-11 ] [ 2.657105e-10 2.943765e-10 2.654332e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -20.3668113 -16.6353916 -1.0904071 ] [ -16.8021717 1.2699436 0.7021225 ] [ 42.9288855 -23.7823826 4.0522087 ] [ 2.2010461 -27.8975353 18.8537994 ] [ -23.8750443 38.8200452 -21.8141364 ] [ 15.9140957 28.2253207 -0.7035871 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.263122917394716e-08 -2.665283571895987e-08 -1.747024777167701e-09 ] [ -2.692004689819605e-08 2.034673962417842e-09 1.124924263705665e-09 ] [ 6.87796572717614e-08 -3.810357770256816e-08 6.492354095231516e-09 ] [ 3.526464631776827e-09 -4.469677920385017e-08 3.020711686080321e-08 ] [ -3.825203811317488e-08 6.219656935026386e-08 -3.495009963096887e-08 ] [ 2.549719228177987e-08 4.522194931269652e-08 -1.127270811603821e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 15.234672 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.440863550505405e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.796209 0.6084009 1.1331003 ] [ 0.5060295 2.5900561 2.6419738 ] [ 3.1994883 1.230129 0.7787509 ] [ 2.3153093 0.9165248 3.1042061 ] [ 1.390208 2.9036605 0.316519 ] [ 2.9093086 3.2117847 2.2876247 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.96209e-11 6.084009000000001e-11 1.1331003e-10 ] [ 5.060295e-11 2.5900561e-10 2.6419738e-10 ] [ 3.1994883e-10 1.230129e-10 7.787509e-11 ] [ 2.3153093e-10 9.165248000000001e-11 3.1042061e-10 ] [ 1.390208e-10 2.9036605e-10 3.16519e-11 ] [ 2.9093086e-10 3.2117847e-10 2.2876247e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.4e-06 -4.3e-06 4.7e-06 ] [ -3.6e-06 1e-06 1.7e-06 ] [ -1.1e-06 2.8e-06 3.2e-06 ] [ -1.3e-06 -4.9e-06 -2.8e-06 ] [ 5e-06 5.3e-06 5e-07 ] [ -4e-07 1e-07 -7.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.2430472876e-15 -6.8893595262e-15 7.530230179799999e-15 ] [ -5.767835882399999e-15 1.602176634e-15 2.7237002778e-15 ] [ -1.7623942974e-15 4.486094575199999e-15 5.1269652288e-15 ] [ -2.0828296242e-15 -7.850665506599998e-15 -4.486094575199999e-15 ] [ 8.010883169999999e-15 8.4915361602e-15 8.010883169999999e-16 ] [ -6.408706536e-16 1.602176634e-16 -1.15356717648e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.423038 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.951696101089409e-18 } }