{ "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" [ [ -5.8675023 -11.0626527 2.0328412 ] [ -11.331954 11.5319167 -14.4426503 ] [ -11.9174959 4.9868728 11.3278014 ] [ 2.9204899 -8.6658491 -10.3082308 ] [ 14.531771 -13.4190444 9.0255185 ] [ 11.6646913 16.6287568 2.3647199 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.400775085001257e-09 -1.772432366599701e-08 3.256970671272521e-09 ] [ -1.815579191636283e-08 1.847616748197439e-08 -2.313967684369309e-08 ] [ -1.90939334667708e-08 7.989851076890155e-09 1.814913871767248e-08 ] [ 4.679140677612996e-09 -1.388422094178993e-08 -1.651560652563913e-08 ] [ 2.328246394683881e-08 -2.149967938828855e-08 1.446047485043473e-08 ] [ 1.868889584368308e-08 2.664220559742861e-08 3.788698969734816e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.11951881 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.914902447054855e-20 } "relaxed-configuration-positions" { "source-value" [ [ 0.3273342 0.3748639 2.5624359 ] [ 0.9463025 2.1963282 0.9353599 ] [ 1.1207189 2.6793236 3.4236091 ] [ 3.2225896 1.356252 0.2563528 ] [ 2.7869594 0.9044734 2.6965162 ] [ 3.0000428 3.3163373 1.9267249 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.273342e-11 3.748639e-11 2.5624359e-10 ] [ 9.463025e-11 2.1963282e-10 9.353599e-11 ] [ 1.1207189e-10 2.6793236e-10 3.4236091e-10 ] [ 3.2225896e-10 1.356252e-10 2.563528e-11 ] [ 2.7869594e-10 9.044734e-11 2.6965162e-10 ] [ 3.0000428e-10 3.3163373e-10 1.9267249e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.7e-05 -7.25e-05 -3.8e-06 ] [ -1.53e-05 0.000104 -3.89e-05 ] [ 0.0001163 -4.27e-05 -0.0001084 ] [ -5.18e-05 -3.17e-05 5.46e-05 ] [ 7.28e-05 7.67e-05 4.89e-05 ] [ -6.5e-05 -3.39e-05 4.77e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.132406813799999e-14 -1.16157805965e-13 -6.088271209199999e-15 ] [ -2.45133025002e-14 1.66626369936e-13 -6.232467106259999e-14 ] [ 1.863331425342e-13 -6.84129422718e-14 -1.736759471256e-13 ] [ -8.299274964119999e-14 -5.078899929779999e-14 8.74788442164e-14 ] [ 1.166384589552e-13 1.228869478278e-13 7.834643740259999e-14 ] [ -1.0414148121e-13 -5.431378789259999e-14 7.64238254418e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.62566 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.304595051282844e-18 } }