{ "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" [ [ 0.8494568 1.09498 0.2360667 ] [ 0.557157 2.835915 1.114432 ] [ 0.135541 1.869398 2.917972 ] [ 1.620291 0.3348641 1.837353 ] [ 2.814436 1.836887 0.4161362 ] [ 2.451507 2.913738 2.050042 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.494568e-11 1.09498e-10 2.360667e-11 ] [ 5.57157e-11 2.835915e-10 1.114432e-10 ] [ 1.35541e-11 1.869398e-10 2.917972e-10 ] [ 1.620291e-10 3.348641e-11 1.837353e-10 ] [ 2.814436e-10 1.836887e-10 4.161362e-11 ] [ 2.451507e-10 2.913738e-10 2.050042e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.6770493 -14.4882718 -26.5205696 ] [ -19.0576342 25.0002741 -4.7849773 ] [ -9.2136799 -1.0988754 15.2730406 ] [ 5.284532 -26.2850977 14.5102357 ] [ 20.9796138 -1.3355273 -13.4403246 ] [ 15.6842177 18.2074982 14.9625952 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.1913048629989e-08 -2.321277035375594e-08 -4.249063658341921e-08 ] [ -3.053369596299851e-08 4.005485467661175e-08 -7.666378761118708e-09 ] [ -1.476194252731488e-08 -1.760592475052248e-09 2.44701085778492e-08 ] [ 8.466753622269465e-09 -4.211336901038386e-08 2.324796040083753e-08 ] [ 3.361304674377305e-08 -2.139750616500148e-09 -2.153377385008311e-08 ] [ 2.512888691447755e-08 2.917162793929808e-08 2.39727202159343e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 7.3290768 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.174247550100768e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7765556 1.2152157 -0.2847406 ] [ 0.0085248 3.070612 1.026694 ] [ 0.6625671 1.8051574 3.2002931 ] [ 1.4305627 -0.0502604 1.8888679 ] [ 3.1590884 1.4948214 0.7147284 ] [ 2.3910902 3.3502359 2.0261591 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.765556e-11 1.2152157e-10 -2.847406e-11 ] [ 8.524800000000001e-13 3.070612e-10 1.026694e-10 ] [ 6.625671e-11 1.8051574e-10 3.2002931e-10 ] [ 1.4305627e-10 -5.02604e-12 1.8888679e-10 ] [ 3.1590884e-10 1.4948214e-10 7.147284000000001e-11 ] [ 2.3910902e-10 3.3502359e-10 2.0261591e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.34e-05 -1.14e-05 -1.63e-05 ] [ 3.97e-05 4e-06 9.5e-06 ] [ 1.43e-05 -4.3e-06 -5.18e-05 ] [ -1.08e-05 -5.4e-05 2.3e-05 ] [ 1.97e-05 4.44e-05 3.64e-05 ] [ 5e-07 2.14e-05 -7e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.0157799775872e-13 -1.826481347712e-14 -2.611547891904e-14 ] [ 6.360641184576e-14 6.4087064832e-15 1.52206778976e-14 ] [ 2.291112567744e-14 -6.889359469440001e-15 -8.299274895744e-14 ] [ -1.730350750464e-14 -8.65175375232e-14 3.68500622784e-14 ] [ 3.156287942976e-14 7.113664196352e-14 5.831922899712e-14 ] [ 8.010883104e-16 3.428657968511999e-14 -1.12152363456e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.148122 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.426996691742614e-18 } }