{ "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" [ [ 1.691051 2.220945 1.919277 ] [ 2.666072 2.808957 4.219459 ] [ 1.090931 4.286689 3.184511 ] [ 3.947256 1.730986 2.765408 ] [ 5.245402 2.932614 3.956238 ] [ 3.932067 4.011287 2.276365 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.691051e-10 2.220945e-10 1.919277e-10 ] [ 2.666072e-10 2.808957e-10 4.219459e-10 ] [ 1.090931e-10 4.286689e-10 3.184511e-10 ] [ 3.947256e-10 1.730986e-10 2.765408e-10 ] [ 5.245402000000001e-10 2.932614e-10 3.956238e-10 ] [ 3.932067e-10 4.011287e-10 2.276365e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.5194656 -0.576783 -1.0783045 ] [ -2.820854 2.0144017 5.0890146 ] [ -1.0682244 0.6901439 -0.2819084 ] [ -0.1975607 -9.3675588 -6.3781378 ] [ 5.4980325 2.8160424 4.9894217 ] [ 0.1080722 4.4237537 -2.3400856 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.434452260429845e-09 -9.241082378748865e-10 -1.727634260003434e-09 ] [ -4.519506329490163e-09 3.227427308639775e-09 8.153500215029863e-09 ] [ -1.711484159448108e-09 1.105732421567733e-09 -4.516670476871348e-10 ] [ -3.165271347288826e-10 -1.50084837033293e-08 -1.021890326740075e-08 ] [ 8.808819131898577e-09 4.511797296461522e-09 7.993934799052191e-09 ] [ 1.731507521984217e-10 7.087634754317497e-09 -3.749230438990741e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.1060403 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.458948487672262e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7143299 2.0455066 2.3267826 ] [ 2.7852836 3.9053165 3.8562968 ] [ 0.3321558 3.7702935 3.460439 ] [ 4.0721694 1.7186152 2.0156911 ] [ 4.8335835 2.4308085 4.3309781 ] [ 4.8352568 4.1209378 2.3310704 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7143299e-10 2.0455066e-10 2.3267826e-10 ] [ 2.7852836e-10 3.9053165e-10 3.8562968e-10 ] [ 3.321558e-11 3.7702935e-10 3.460439e-10 ] [ 4.0721694e-10 1.7186152e-10 2.0156911e-10 ] [ 4.8335835e-10 2.4308085e-10 4.330978100000001e-10 ] [ 4.8352568e-10 4.1209378e-10 2.3310704e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.2e-06 -1.8e-05 -3.81e-05 ] [ 4.02e-05 3.03e-05 -2.81e-05 ] [ -2.03e-05 -9.3e-06 3.47e-05 ] [ -1.18e-05 -7.7e-06 -2.55e-05 ] [ -1.3e-06 1.99e-05 3.31e-05 ] [ -5e-07 -1.52e-05 2.38e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.93349504896e-15 -2.88391791744e-14 -6.104292925248e-14 ] [ 6.440750015616e-14 4.854595161024e-14 -4.502116304448e-14 ] [ -3.252418540224e-14 -1.490024257344e-14 5.559552874176001e-14 ] [ -1.890568412544e-14 -1.233675998016e-14 -4.08555038304e-14 ] [ -2.08282960704e-15 3.188331475392e-14 5.303204614848e-14 ] [ -8.010883104e-16 -2.435308463616e-14 3.813180357504e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.333823 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.136313947648532e-18 } }