{ "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" [ [ 0.6618616 0.5532969 2.6678 ] [ 1.355444 2.726321 1.335983 ] [ 0.8455628 2.30582 2.977156 ] [ 2.930365 0.9373095 0.4139469 ] [ 2.829062 1.427351 2.413715 ] [ 2.781652 2.87748 1.992398 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.618616000000001e-11 5.532969e-11 2.6678e-10 ] [ 1.355444e-10 2.726321e-10 1.335983e-10 ] [ 8.455628e-11 2.30582e-10 2.977156e-10 ] [ 2.930365e-10 9.373095e-11 4.139469e-11 ] [ 2.829062e-10 1.427351e-10 2.413715e-10 ] [ 2.781652e-10 2.87748e-10 1.992398e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -14.5087858 -30.0090755 4.1607721 ] [ -38.8560382 20.7158604 -44.1014999 ] [ -25.1700524 14.1224167 31.0644096 ] [ 6.2116118 -11.9963778 -16.7309592 ] [ 27.2422126 -53.0400796 24.1832245 ] [ 45.081052 60.2072559 1.4240529 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.324563740495503e-08 -4.807983917792207e-08 6.666291783096919e-09 ] [ -6.225423598095172e-08 3.319046721263654e-08 -7.065839208199353e-08 ] [ -4.032686949959093e-08 2.262660586593549e-08 4.977067080007508e-08 ] [ 9.952099203445405e-09 -1.922031604544414e-08 -2.680595167379867e-08 ] [ 4.364683612658318e-08 -8.497957550049102e-08 3.874579690945778e-08 ] [ 7.222780755546908e-08 9.646265780550286e-08 2.28158426316244e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 43.101775 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.905665621998193e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0438108 0.2771984 2.7555983 ] [ 1.4294922 3.0179497 0.554356 ] [ 0.4237598 2.5887639 2.9118915 ] [ 2.0495638 0.7063893 0.3980709 ] [ 3.5386921 0.962856 2.5124035 ] [ 2.9186286 3.2744211 2.6686788 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0438108e-10 2.771984e-11 2.7555983e-10 ] [ 1.4294922e-10 3.0179497e-10 5.54356e-11 ] [ 4.237598000000001e-11 2.5887639e-10 2.9118915e-10 ] [ 2.0495638e-10 7.063893e-11 3.980709e-11 ] [ 3.5386921e-10 9.62856e-11 2.5124035e-10 ] [ 2.9186286e-10 3.2744211e-10 2.6686788e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.8e-05 5.1e-06 -3e-06 ] [ 2e-06 1e-07 -4.53e-05 ] [ -4.54e-05 -1.5e-05 2.35e-05 ] [ -4.7e-06 -7e-06 7.8e-06 ] [ -2.32e-05 1.41e-05 -1.12e-05 ] [ 5.34e-05 2.8e-06 2.82e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.88391791744e-14 8.17110076608e-15 -4.8065298624e-15 ] [ 3.2043532416e-15 1.6021766208e-16 -7.257860092224001e-14 ] [ -7.273881858432e-14 -2.4032649312e-14 3.76511505888e-14 ] [ -7.53023011776e-15 -1.12152363456e-14 1.249697764224e-14 ] [ -3.717049760256e-14 2.259069035328e-14 -1.794437815296e-14 ] [ 8.555623155072e-14 4.48609453824e-15 4.518138070656001e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.148122 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.426996691742614e-18 } }