{ "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" [ [ 1.08267 0.385996 1.67532 ] [ 0.7413004 2.189146 0.0242846 ] [ 0.0452684 1.636125 2.5153 ] [ 2.351375 1.598321 0.2166547 ] [ 2.147702 1.718144 2.949578 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.08267e-10 3.85996e-11 1.67532e-10 ] [ 7.413004e-11 2.189146e-10 2.42846e-12 ] [ 4.52684e-12 1.636125e-10 2.5153e-10 ] [ 2.351375e-10 1.598321e-10 2.166547e-11 ] [ 2.147702e-10 1.718144e-10 2.949578e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.5615357 -29.022233 1.519408 ] [ -8.1040241 12.1911056 -9.5102249 ] [ -19.1628065 6.1089514 1.0763258 ] [ 9.930532 1.9096154 -0.326541 ] [ 20.8978343 8.8125606 7.2410321 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.706209232684563e-09 -4.649874319601025e-08 2.434359975056487e-09 ] [ -1.298407794741976e-08 1.953230437402395e-08 -1.523705999333002e-08 ] [ -3.070220056321427e-08 9.787619110683429e-09 1.724464033123857e-09 ] [ 1.591046620250627e-08 3.059541148599641e-09 -5.231763559326528e-10 ] [ 3.348202154081234e-08 1.411927856270322e-08 1.160141234108233e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -0.32091684 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.141654582690143e-20 } "relaxed-configuration-positions" { "source-value" [ [ 1.6975967 0.371338 1.5597537 ] [ 0.3248411 2.1376159 0.1099403 ] [ -0.0534748 2.1691715 2.4585108 ] [ 2.536321 1.3967221 -0.4634494 ] [ 1.8630318 1.4528845 3.716382 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6975967e-10 3.71338e-11 1.5597537e-10 ] [ 3.248411e-11 2.1376159e-10 1.099403e-11 ] [ -5.347480000000001e-12 2.1691715e-10 2.4585108e-10 ] [ 2.536321e-10 1.3967221e-10 -4.634494e-11 ] [ 1.8630318e-10 1.4528845e-10 3.716382e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.54e-05 -8.05e-05 -1.76e-05 ] [ -4.06e-05 6.29e-05 -6.66e-05 ] [ 4.59e-05 -3.45e-05 -4.08e-05 ] [ -3.87e-05 1.17e-05 5.04e-05 ] [ 1.8e-05 4.04e-05 7.45e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.467351996032e-14 -1.289752179744e-13 -2.819830852608e-14 ] [ -6.504837080448e-14 1.0077690944832e-13 -1.0670496294528e-13 ] [ 7.353990689472e-14 -5.52750934176e-14 -6.536880612864e-14 ] [ -6.200423522496e-14 1.874546646336e-14 8.074970168832e-14 ] [ 2.88391791744e-14 6.472793548032e-14 1.193621582496e-13 ] ] } "relaxed-potential-energy" { "source-value" -15.983578 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.560851498833322e-18 } }