{ "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" [ [ 1.009597 0.3628337 1.078601 ] [ 0.0352367 0.1167127 2.680629 ] [ 0.3335965 1.756245 2.167544 ] [ 2.066416 0.0072977 2.832654 ] [ 2.311694 1.962933 1.086024 ] [ 2.552148 1.611374 2.965257 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.009597e-10 3.628337e-11 1.078601e-10 ] [ 3.52367e-12 1.167127e-11 2.680629e-10 ] [ 3.335965e-11 1.756245e-10 2.167544e-10 ] [ 2.066416e-10 7.2977e-13 2.832654e-10 ] [ 2.311694e-10 1.962933e-10 1.086024e-10 ] [ 2.552148e-10 1.611374e-10 2.965257e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 6.6793209 -6.056366 -36.0811484 ] [ -15.5993978 21.6140886 5.0585878 ] [ -33.0751041 -8.4837016 21.2284163 ] [ 14.804234 -35.6811007 13.0984557 ] [ 12.9349977 0.4549959 -10.3371282 ] [ 14.2559492 28.1520838 7.0328168 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.070145178880081e-08 -9.703368012208012e-09 -5.780837241809532e-08 ] [ -2.499299045371896e-08 3.46295874348198e-08 8.104751107424105e-09 ] [ -5.299215851954623e-08 -1.359238836136355e-08 3.401167229246964e-08 ] [ 2.371899760365247e-08 -5.716742534595051e-08 2.09860394911245e-08 ] [ 2.072415090504177e-08 7.289837935398547e-10 -1.656190512825239e-08 ] [ 2.284054851555246e-08 4.510461049116242e-08 1.126781465532947e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 12.511202 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.00451553425062e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0291996 0.0340014 0.2154602 ] [ -0.0107861 0.1464 2.4343822 ] [ 0.1106174 2.0657043 2.7888946 ] [ 2.2413945 -0.1646066 3.4973967 ] [ 2.3234493 2.0261316 0.7734258 ] [ 2.6148135 1.7097654 3.1011493 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0291996e-10 3.40014e-12 2.154602e-11 ] [ -1.07861e-12 1.464e-11 2.4343822e-10 ] [ 1.106174e-11 2.0657043e-10 2.7888946e-10 ] [ 2.2413945e-10 -1.646066e-11 3.4973967e-10 ] [ 2.3234493e-10 2.0261316e-10 7.734258e-11 ] [ 2.6148135e-10 1.7097654e-10 3.1011493e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.3e-06 1.33e-05 2.44e-05 ] [ 1.07e-05 -1.52e-05 3.6e-06 ] [ -2.22e-05 2.53e-05 -1.72e-05 ] [ 1.56e-05 3.68e-05 -2.4e-06 ] [ -2.7e-06 1.31e-05 -1.31e-05 ] [ -5.8e-06 -7.34e-05 4.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.889359469440001e-15 2.130894905664e-14 3.909310954752e-14 ] [ 1.714328984256e-14 -2.435308463616e-14 5.76783583488e-15 ] [ -3.556832098176e-14 4.053506850624e-14 -2.755743787776e-14 ] [ 2.499395528448e-14 5.896009964544001e-14 -3.84522388992e-15 ] [ -4.32587687616e-15 2.098851373248e-14 -2.098851373248e-14 ] [ -9.292624400640001e-15 -1.1759976396672e-13 7.69044777984e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.25193 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.283410904727815e-18 } }