{ "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" [ [ 0.0140975 0.5833675 2.011711 ] [ 0.3860738 2.863563 1.325373 ] [ 1.128451 1.622429 0.5509609 ] [ 2.086312 0.6042059 2.517228 ] [ 2.318087 2.883056 0.8671461 ] [ 2.902063 1.818717 2.74846 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.40975e-12 5.833675e-11 2.011711e-10 ] [ 3.860738e-11 2.863563e-10 1.325373e-10 ] [ 1.128451e-10 1.622429e-10 5.509609e-11 ] [ 2.086312e-10 6.042059e-11 2.517228e-10 ] [ 2.318087e-10 2.883056e-10 8.671461e-11 ] [ 2.902063e-10 1.818717e-10 2.74846e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.7261993 1.1699018 1.8008405 ] [ -29.3363631 30.3880705 21.5534649 ] [ 4.6715042 -47.9540613 -27.0355948 ] [ -41.4070335 -64.9350238 -12.5118383 ] [ 25.3027632 15.7012095 5.5907497 ] [ 43.4953285 65.6299034 10.602378 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.367852782101325e-09 1.874389312591837e-09 2.885264546889783e-09 ] [ -4.700203509811981e-08 4.868705610632217e-08 3.453245756001342e-08 ] [ 7.484574813209008e-09 -7.683087588727006e-08 -4.331579791798205e-08 ] [ -6.634138101038239e-08 -1.040373770034516e-07 -2.004617480749002e-08 ] [ 4.05394956406786e-08 2.515611077918285e-08 8.957368462084614e-09 ] [ 6.968719843671593e-08 1.051506968528424e-07 1.698688215648426e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 10.235286 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.639873593640155e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.2699108 0.9021906 2.4881275 ] [ 0.4779665 3.0704709 1.5640468 ] [ 0.8692286 1.1667319 0.2144752 ] [ 2.4670616 0.3879737 1.7762452 ] [ 2.675118 2.5562566 0.8521657 ] [ 2.0757987 2.2917146 3.1258186 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.699108e-11 9.021906e-11 2.4881275e-10 ] [ 4.779665e-11 3.0704709e-10 1.5640468e-10 ] [ 8.692286e-11 1.1667319e-10 2.144752e-11 ] [ 2.4670616e-10 3.879737e-11 1.7762452e-10 ] [ 2.675118e-10 2.5562566e-10 8.521657e-11 ] [ 2.0757987e-10 2.2917146e-10 3.1258186e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.2e-06 -2.19e-05 4.8e-06 ] [ 6.7e-06 2.9e-05 1e-07 ] [ 9.6e-06 -9.2e-06 -1.28e-05 ] [ -1.26e-05 1.02e-05 8.5e-06 ] [ -1.75e-05 -5.3e-06 7.7e-06 ] [ 7.7e-06 -2.8e-06 -8.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.93349504896e-15 -3.508766799552e-14 7.69044777984e-15 ] [ 1.073458335936e-14 4.64631220032e-14 1.6021766208e-16 ] [ 1.538089555968e-14 -1.474002491136e-14 -2.050786074624e-14 ] [ -2.018742542208e-14 1.634220153216e-14 1.36185012768e-14 ] [ -2.8038090864e-14 -8.491536090240001e-15 1.233675998016e-14 ] [ 1.233675998016e-14 -4.48609453824e-15 -1.329806595264e-14 ] ] } "relaxed-potential-energy" { "source-value" -26.519951 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.248964547696158e-18 } }