{ "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" [ [ 0.099853 0.7165901 0.5986145 ] [ 0.2043706 1.471965 2.579922 ] [ 1.736021 0.3195483 2.600696 ] [ 1.725047 2.389347 1.166635 ] [ 1.83697 2.73027 2.853175 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.9853e-12 7.165901e-11 5.986145000000001e-11 ] [ 2.043706e-11 1.471965e-10 2.579922e-10 ] [ 1.736021e-10 3.195483e-11 2.600696e-10 ] [ 1.725047e-10 2.389347e-10 1.166635e-10 ] [ 1.83697e-10 2.73027e-10 2.853175e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -15.4542334 -8.8708489 -22.2856915 ] [ -38.0376342 -3.6792566 20.2443437 ] [ 20.6942779 -41.6274425 19.0846349 ] [ 18.617264 25.6522567 -43.5781239 ] [ 14.1803257 28.5252913 26.5348368 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.47604114458665e-08 -1.42126667142294e-08 -3.570561389966128e-08 ] [ -6.094300822578252e-08 -5.894818906444097e-09 3.243501417957977e-08 ] [ 3.315588823571812e-08 -6.669451515719631e-08 3.057695585328374e-08 ] [ 2.982814512406149e-08 4.109944595550016e-08 -6.981985129090572e-08 ] [ 2.271938631186939e-08 4.570255482236964e-08 4.251349515770349e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 35.317761 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.658529097320203e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.2106555 1.116502 0.3884025 ] [ 0.3491396 1.1089608 2.8223785 ] [ 1.5998965 -0.7525803 3.5299628 ] [ 1.6524001 3.080915 0.3121539 ] [ 1.7901697 3.0739229 2.7461447 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.106555e-11 1.116502e-10 3.884025e-11 ] [ 3.491396e-11 1.1089608e-10 2.8223785e-10 ] [ 1.5998965e-10 -7.525803000000001e-11 3.5299628e-10 ] [ 1.6524001e-10 3.080915e-10 3.121539e-11 ] [ 1.7901697e-10 3.0739229e-10 2.7461447e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.33e-05 3.47e-05 1.34e-05 ] [ 2.9e-05 1.64e-05 -2.59e-05 ] [ -9.8e-06 -5.39e-05 2.54e-05 ] [ -2.9e-05 -2.06e-05 8.4e-06 ] [ -1.35e-05 2.35e-05 -2.13e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.733071526464e-14 5.559552874176001e-14 2.146916671872e-14 ] [ 4.64631220032e-14 2.627569658112e-14 -4.149637447872e-14 ] [ -1.570133088384e-14 -8.635731986112e-14 4.069528616832e-14 ] [ -4.64631220032e-14 -3.300483838848e-14 1.345828361472e-14 ] [ -2.16293843808e-14 3.76511505888e-14 -3.412636202304e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.419499 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.669387769824898e-18 } }