{ "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" [ [ 0.7826629 0.079664 0.3147899 ] [ 0.4004832 1.295186 0.8087518 ] [ 0.7320587 0.6290848 2.788823 ] [ 1.344916 2.662801 0.2560168 ] [ 0.3963272 2.667865 2.000738 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.826629000000001e-11 7.9664e-12 3.147899e-11 ] [ 4.004832e-11 1.295186e-10 8.087518e-11 ] [ 7.320586999999999e-11 6.290848000000001e-11 2.788823e-10 ] [ 1.344916e-10 2.662801e-10 2.560168e-11 ] [ 3.963272e-11 2.667865e-10 2.000738e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 81.815908 -199.7129553 -77.7614548 ] [ -116.8408347 136.3981387 43.6695475 ] [ 3.0998923 -10.4881513 8.1094227 ] [ 44.4866417 23.3971118 -49.2316309 ] [ -12.5616073 50.4058561 75.2141155 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.310835360870936e-07 -3.199754304887465e-07 -1.245875859064071e-07 ] [ -1.871996552533964e-07 2.185339107462311e-07 6.996632862185311e-08 ] [ 4.966575010976517e-09 -1.680387094671672e-08 1.299272756516919e-08 ] [ 7.127545785687003e-08 3.748630582904568e-08 -7.887776868169237e-08 ] [ -2.012591370154383e-08 8.075908486018635e-08 1.205062984010772e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 84.639459 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.35607363524201e-17 } "relaxed-configuration-positions" { "source-value" [ [ -0.0643771 -0.4086219 0.0307421 ] [ 0.7312883 1.4669167 1.2338184 ] [ 2.108586 0.7360299 3.0134149 ] [ 1.984004 2.8583699 -0.2127913 ] [ -1.1030533 2.6819061 2.1039353 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.437710000000001e-12 -4.086219e-11 3.07421e-12 ] [ 7.312883000000001e-11 1.4669167e-10 1.2338184e-10 ] [ 2.108586e-10 7.360299e-11 3.0134149e-10 ] [ 1.984004e-10 2.8583699e-10 -2.127913e-11 ] [ -1.1030533e-10 2.6819061e-10 2.1039353e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5e-07 -5.9e-06 -1e-05 ] [ 4.1e-06 1.77e-05 1.9e-06 ] [ 2.04e-05 -1.97e-05 2.19e-05 ] [ 3e-07 -2e-06 -1.56e-05 ] [ -2.44e-05 9.8e-06 1.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.010883169999999e-16 -9.452842140600001e-15 -1.602176634e-14 ] [ 6.568924199399999e-15 2.83585264218e-14 3.0441356046e-15 ] [ 3.26844033336e-14 -3.15628796898e-14 3.50876682846e-14 ] [ 4.806529901999999e-16 -3.204353268e-15 -2.49939554904e-14 ] [ -3.909310986959999e-14 1.57013310132e-14 2.8839179412e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.595203 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.33840932150867e-18 } }