{ "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" [ [ 2.082752 2.058358 1.918508 ] [ 1.804708 3.969119 3.022657 ] [ 3.997636 1.573064 0.3548062 ] [ 3.986466 2.315414 3.180743 ] [ 3.658552 3.790773 1.50531 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.082752e-10 2.058358e-10 1.918508e-10 ] [ 1.804708e-10 3.969119e-10 3.022657e-10 ] [ 3.997636e-10 1.573064e-10 3.548062000000001e-11 ] [ 3.986466e-10 2.315414e-10 3.180743e-10 ] [ 3.658552e-10 3.790773e-10 1.50531e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.070409 -2.2364191 -1.3349451 ] [ -1.4591786 1.9931214 0.4444703 ] [ -0.6693943 0.6152781 -0.4235823 ] [ 2.3779853 -1.4258327 2.9334723 ] [ 0.8209965 1.0538524 -1.6194152 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.714984288623306e-09 -3.583138425851309e-09 -2.138817846892793e-09 ] [ -2.337861857752832e-09 3.193332535805367e-09 7.121199291669701e-10 ] [ -1.072487906392786e-09 9.857841952319154e-10 -6.786536636359782e-10 ] [ 3.809952483655481e-09 -2.284435835933131e-09 4.699940775546238e-09 ] [ 1.315381408895781e-09 1.688457690964821e-09 -2.594589194184436e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.916208432689674 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.588751744872915e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1040241 1.5489969 2.2652652 ] [ 1.7926762 3.9110594 2.2892471 ] [ 3.3990465 2.1237897 0.3497026 ] [ 4.1263443 2.1891882 3.3502634 ] [ 4.1080229 3.9336939 1.7275459 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1040241e-10 1.5489969e-10 2.2652652e-10 ] [ 1.7926762e-10 3.9110594e-10 2.2892471e-10 ] [ 3.3990465e-10 2.1237897e-10 3.497026e-11 ] [ 4.1263443e-10 2.1891882e-10 3.3502634e-10 ] [ 4.1080229e-10 3.9336939e-10 1.7275459e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.8e-06 1.74e-05 -6.5e-06 ] [ -5e-07 1.8e-06 6.8e-06 ] [ 8e-06 -1.9e-06 2e-07 ] [ 2.6e-06 1.5e-06 -3e-07 ] [ -1.8e-05 -1.88e-05 -2e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.24969777452e-14 2.78778734316e-14 -1.0414148121e-14 ] [ -8.010883169999999e-16 2.8839179412e-15 1.08948011112e-14 ] [ 1.2817413072e-14 -3.0441356046e-15 3.204353268e-16 ] [ 4.165659248399999e-15 2.403264951e-15 -4.806529901999999e-16 ] [ -2.8839179412e-14 -3.012092071919999e-14 -3.204353268e-16 ] ] } "relaxed-potential-energy" { "source-value" -12.674324432689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.03065064577907e-18 } }