{ "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" [ [ 2.146483 1.678803 1.689789 ] [ 0.9939717 3.024801 3.865516 ] [ 2.198915 3.863733 1.927968 ] [ 4.22715 2.33689 1.172014 ] [ 3.633184 2.755923 3.714191 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.146483e-10 1.678803e-10 1.689789e-10 ] [ 9.939717000000001e-11 3.024801e-10 3.865516e-10 ] [ 2.198915e-10 3.863733e-10 1.927968e-10 ] [ 4.22715e-10 2.33689e-10 1.172014e-10 ] [ 3.633184e-10 2.755923e-10 3.714191e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.5021176 -3.4801585 1.5087347 ] [ 1.6190638 -0.9001062 -0.6564152 ] [ 0.4770038 3.6462704 -0.2928824 ] [ 1.6347952 1.101097 0.6614335 ] [ -1.2287452 -0.3671028 -1.2208707 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.008834321212206e-09 -5.575828585378397e-09 2.417259463329702e-09 ] [ 2.594026167943607e-09 -1.442129109877129e-09 -1.051693086977756e-09 ] [ 7.642443363927591e-10 5.841969187995065e-09 -4.692493339237939e-10 ] [ 2.61923064923606e-09 1.764151870633018e-09 1.059733289913917e-09 ] [ -1.96866683236022e-09 -5.881635235902183e-10 -1.956050492559731e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.424441 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.311050213830897e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0180487 1.4801961 1.9213333 ] [ 1.1005982 2.9478084 3.7175319 ] [ 2.3254716 4.0644513 1.8534722 ] [ 4.1792832 2.5162517 1.2302591 ] [ 3.576302 2.6514425 3.6468814 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0180487e-10 1.4801961e-10 1.9213333e-10 ] [ 1.1005982e-10 2.9478084e-10 3.7175319e-10 ] [ 2.3254716e-10 4.0644513e-10 1.8534722e-10 ] [ 4.1792832e-10 2.5162517e-10 1.2302591e-10 ] [ 3.576302e-10 2.6514425e-10 3.6468814e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.8e-06 -3e-07 5e-07 ] [ 5.5e-06 -4.8e-06 5e-07 ] [ 5.7e-06 1.4e-06 -7.2e-06 ] [ -5.6e-06 3.5e-06 -5e-07 ] [ -3.8e-06 2e-07 6.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.88391791744e-15 -4.8065298624e-16 8.010883104e-16 ] [ 8.8119714144e-15 -7.69044777984e-15 8.010883104e-16 ] [ 9.13240673856e-15 2.24304726912e-15 -1.153567166976e-14 ] [ -8.972189076479999e-15 5.6076181728e-15 -8.010883104e-16 ] [ -6.08827115904e-15 3.2043532416e-16 1.073458335936e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.840953 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.538000454779163e-18 } }