{ "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" [ [ -5.7061271 -21.5367907 -41.7817784 ] [ -31.3617309 -26.2915084 18.6958786 ] [ -27.909188 40.5597938 1.2808462 ] [ 18.6136745 -42.8516115 19.7276534 ] [ 15.2870301 19.7651051 -24.0738233 ] [ 31.0763414 30.3550116 26.1512236 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.142223434933303e-09 -3.450574254660287e-08 -6.694178852792643e-08 ] [ -5.024703203580095e-08 -4.212364008404682e-08 2.995409959823504e-08 ] [ -4.471544851911191e-08 6.49839533708288e-08 2.052141836480521e-09 ] [ 2.982239411108113e-08 -6.865585010890442e-08 3.160718506072563e-08 ] [ 2.449252222768589e-08 3.166718929887485e-08 -3.857051686453031e-08 ] [ 4.978978765107914e-08 4.86340899096328e-08 4.189887905723322e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 36.528133 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.852452069407296e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4310148 -0.2025027 0.6141335 ] [ -0.2713075 0.0921172 2.5555163 ] [ 0.253421 2.4300192 2.6608344 ] [ 2.2075439 -0.4877704 3.0777281 ] [ 1.9557441 2.1354009 0.7194498 ] [ 2.7322719 1.8501319 3.1830469 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4310148e-10 -2.025027e-11 6.141335e-11 ] [ -2.713075e-11 9.21172e-12 2.5555163e-10 ] [ 2.53421e-11 2.4300192e-10 2.6608344e-10 ] [ 2.2075439e-10 -4.877704e-11 3.0777281e-10 ] [ 1.9557441e-10 2.1354009e-10 7.194498e-11 ] [ 2.7322719e-10 1.8501319e-10 3.1830469e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.4e-06 -2.3e-06 -1.88e-05 ] [ -1.88e-05 -1.02e-05 6.1e-06 ] [ -1.4e-06 1.49e-05 2.4e-06 ] [ 8.5e-06 -1.55e-05 1.09e-05 ] [ 1.7e-06 1.2e-06 -2.1e-06 ] [ 5.6e-06 1.18e-05 1.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.04957713152e-15 -3.68500622784e-15 -3.012092047104e-14 ] [ -3.012092047104e-14 -1.634220153216e-14 9.77327738688e-15 ] [ -2.24304726912e-15 2.387243164992e-14 3.84522388992e-15 ] [ 1.36185012768e-14 -2.48337376224e-14 1.746372516672e-14 ] [ 2.72370025536e-15 1.92261194496e-15 -3.36457090368e-15 ] [ 8.972189076479999e-15 1.890568412544e-14 2.4032649312e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.187542 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.273094809901807e-18 } }