{ "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" [ [ 0.049795 0.7119441 0.3423404 ] [ 0.1447331 1.623908 1.772641 ] [ 2.54973 0.1092944 1.824085 ] [ 1.77811 2.382187 0.8238028 ] [ 2.019176 2.140924 2.983896 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.9795e-12 7.119441e-11 3.423404e-11 ] [ 1.447331e-11 1.623908e-10 1.772641e-10 ] [ 2.54973e-10 1.092944e-11 1.824085e-10 ] [ 1.77811e-10 2.382187e-10 8.238028e-11 ] [ 2.019176e-10 2.140924e-10 2.983896e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -59.8956324 -470.4799311 -708.5229368 ] [ -31.3961615 437.3466521 710.5535165 ] [ -21.0669064 36.4229526 -232.6084823 ] [ 122.287474 -199.2330813 -68.3607339 ] [ -9.9287738 195.9434077 298.9386364 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.596338270993333e-08 -7.537919523743498e-07 -1.135178893994019e-06 ] [ -5.030219635259039e-08 7.00706586952747e-07 1.138432241342833e-06 ] [ -3.375290518474506e-08 5.835600359700954e-08 -3.726798752112625e-07 ] [ 1.959261334736825e-07 -3.192065875786823e-07 -1.095259705376717e-07 ] [ -1.590764938663139e-08 3.139359494032756e-07 4.789524982399018e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 352.25211 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.643700999191978e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.2059119 0.2425023 0.1774443 ] [ -0.5599397 2.1082481 2.2929267 ] [ 2.722662 -0.2036651 1.5950869 ] [ 2.0069956 2.7524308 0.3343654 ] [ 2.1659143 2.0687414 3.346942 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.059119e-11 2.425023e-11 1.774443e-11 ] [ -5.599397000000001e-11 2.1082481e-10 2.2929267e-10 ] [ 2.722662e-10 -2.036651e-11 1.5950869e-10 ] [ 2.0069956e-10 2.7524308e-10 3.343654e-11 ] [ 2.1659143e-10 2.0687414e-10 3.346942e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.2e-06 -9.6e-06 7.1e-06 ] [ -1.82e-05 9e-07 0.0 ] [ -2.3e-06 6.8e-06 -1.19e-05 ] [ 1.71e-05 -3e-07 5.9e-06 ] [ 5.5e-06 2.1e-06 -1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.5247885948e-15 -1.53808956864e-14 1.13754541014e-14 ] [ -2.915961473879999e-14 1.4419589706e-15 0.0 ] [ -3.685006258199999e-15 1.08948011112e-14 -1.90659019446e-14 ] [ 2.73972204414e-14 -4.806529901999999e-16 9.452842140600001e-15 ] [ 8.811971486999999e-15 3.364570931399999e-15 -1.602176634e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.044174 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.929689415863031e-18 } }