{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.3100327e-10 8.65846e-12 2.476563e-10 ] [ -3.70622e-12 1.5911413e-10 1.1571834e-10 ] [ 1.0664843e-10 2.4139008e-10 3.1387151e-10 ] [ 2.8680345e-10 1.947993e-11 7.665379e-11 ] [ 1.9234718e-10 2.1408822e-10 -4.34875e-12 ] [ 2.522833e-10 3.5149052e-10 1.7136101e-10 ] ] "source-value" [ [ 1.3100327 0.0865846 2.476563 ] [ -0.0370622 1.5911413 1.1571834 ] [ 1.0664843 2.4139008 3.1387151 ] [ 2.8680345 0.1947993 0.7665379 ] [ 1.9234718 2.1408822 -0.0434875 ] [ 2.522833 3.5149052 1.7136101 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 7.7433196083264e-13 5.3360492355744e-12 -1.80661435761408e-12 ] [ -2.635580541216e-13 6.114867290945279e-12 3.77296572432192e-12 ] [ 3.5360038021056e-13 -4.04677770881664e-12 -4.57773904094976e-12 ] [ 2.44828609424448e-12 7.906741623648e-13 -1.53953151492672e-12 ] [ 1.09492750265472e-12 -6.32154807502848e-12 2.78490340227456e-12 ] [ -4.40742766615872e-12 -1.87326490503936e-12 1.36601578689408e-12 ] ] "source-value" [ [ 0.0004833 0.0033305 -0.0011276 ] [ -0.0001645 0.0038166 0.0023549 ] [ 0.0002207 -0.0025258 -0.0028572 ] [ 0.0015281 0.0004935 -0.0009609 ] [ 0.0006834 -0.0039456 0.0017382 ] [ -0.0027509 -0.0011692 0.0008526 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.926095697635546e-18 "source-value" -18.263253 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 2.092460979643576e-08 -2.847705986087899e-08 1.907709891926978e-08 ] [ -8.15322681961129e-08 -1.248570749930161e-07 -1.140984466475841e-07 ] [ 3.661936166241777e-08 1.402949413898491e-07 9.928307345257745e-08 ] [ 1.190333467460665e-08 -2.766338565203429e-08 -8.245545902765472e-10 ] [ -1.977673772647606e-08 1.496483608630184e-08 -2.512516778188768e-08 ] [ 3.186169962891112e-08 2.573774302977838e-08 2.168799664790107e-08 ] ] "source-value" [ [ 13.0601143 -17.7739829 11.9069887 ] [ -50.8884396 -77.9296573 -71.2146496 ] [ 22.856008 87.5652157 61.9676209 ] [ 7.4294772 -17.2661274 -0.5146465 ] [ -12.3436689 9.3403161 -15.6818964 ] [ 19.8865089 16.0642358 13.5365829 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 4.552692374054456e-18 "source-value" 28.415671 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.302275e-10 3.737398e-11 2.647818e-10 ] [ 2.826825e-11 1.480501e-10 1.727575e-10 ] [ 6.414777000000001e-11 2.53008e-10 2.452953e-10 ] [ 2.763361e-10 4.669357e-11 1.77905e-11 ] [ 2.062003e-10 2.101671e-10 3.497139e-11 ] [ 2.601995e-10 2.989286e-10 1.853157e-10 ] ] "source-value" [ [ 1.302275 0.3737398 2.647818 ] [ 0.2826825 1.480501 1.727575 ] [ 0.6414777 2.53008 2.452953 ] [ 2.763361 0.4669357 0.177905 ] [ 2.062003 2.101671 0.3497139 ] [ 2.601995 2.989286 1.853157 ] ] } "instance-id" 1 }