{ "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" [ [ 1.040169 0.3467498 1.049872 ] [ 0.0600036 1.405044 1.572488 ] [ 2.420904 2.65585 0.1683769 ] [ 1.553585 1.595169 0.3590691 ] [ 2.059971 2.654503 2.612695 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.040169e-10 3.467498e-11 1.049872e-10 ] [ 6.00036e-12 1.405044e-10 1.572488e-10 ] [ 2.420904e-10 2.65585e-10 1.683769e-11 ] [ 1.553585e-10 1.595169e-10 3.590691e-11 ] [ 2.059971e-10 2.654503e-10 2.612695e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9131126 -16.4855174 0.8739418 ] [ -12.2032163 3.696592 5.5755418 ] [ 11.4418981 13.0345392 -5.9433115 ] [ -2.7403662 -3.8213131 -7.2321226 ] [ 2.5885717 3.5756993 6.7259505 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.462967659877902e-09 -2.64127105600716e-08 1.400209119899869e-09 ] [ -1.955170785442548e-08 5.922593279036313e-09 8.933002720253149e-09 ] [ 1.833194163339594e-08 2.088363396914114e-08 -9.52223473543178e-09 ] [ -4.390550658070537e-09 -6.122418509576772e-09 -1.158713774847931e-08 ] [ 4.147349059004511e-09 5.728901821470926e-09 1.077616064375807e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 45.687486 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.319942193232732e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6736454 -3.3811143 2.3048039 ] [ -3.4284086 2.155569 2.6010571 ] [ 5.2926554 5.7104042 -1.0986974 ] [ 0.3939026 0.8269265 -3.5839269 ] [ 3.2028379 3.3455303 5.5392643 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6736454e-10 -3.3811143e-10 2.3048039e-10 ] [ -3.4284086e-10 2.155569e-10 2.6010571e-10 ] [ 5.292655400000001e-10 5.7104042e-10 -1.0986974e-10 ] [ 3.939026e-11 8.269265e-11 -3.5839269e-10 ] [ 3.2028379e-10 3.3455303e-10 5.5392643e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 -0.0 0.0 ] [ -0.0 -0.0 -0.0 ] [ 0.0 0.0 0.0 ] [ -0.0 -0.0 -0.0 ] [ 0.0 0.0 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 0.0 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 0.0 } }