{ "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" [ [ 2.38521 1.90546 0.8111876 ] [ 1.820048 1.934055 3.373724 ] [ 3.762919 1.896883 2.504871 ] [ 3.3319 2.668439 4.803022 ] [ 3.103403 4.016922 2.717172 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.38521e-10 1.90546e-10 8.111876000000001e-11 ] [ 1.820048e-10 1.934055e-10 3.373724e-10 ] [ 3.762919e-10 1.896883e-10 2.504871e-10 ] [ 3.3319e-10 2.668439e-10 4.803022000000001e-10 ] [ 3.103403e-10 4.016922e-10 2.717172e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.9137517 -0.389279 -2.7822736 ] [ -15.2544516 -9.4887638 1.2490257 ] [ 11.8387966 -9.4795023 -11.4688814 ] [ 3.2390717 0.6219676 22.073437 ] [ 2.090335 18.7355775 -9.0713077 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.066168231756255e-09 -6.236937127684032e-10 -4.457693714589051e-09 ] [ -2.444032571664516e-08 -1.520267552065336e-08 2.001159775318355e-09 ] [ 1.896784313092653e-08 -1.518783696187983e-08 -1.837517364580798e-08 ] [ 5.189564950834911e-09 9.965019476150861e-10 3.536554470210169e-08 ] [ 3.349085866639968e-09 3.001770424768651e-08 -1.453383711702302e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -10.621772 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.701795476986806e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2773443 1.1222487 1.0823713 ] [ 1.5415596 2.4253242 2.9720573 ] [ 4.070115 2.2053809 2.2753024 ] [ 3.3776221 2.2913373 4.7062723 ] [ 3.136839 4.3774679 3.1739733 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2773443e-10 1.1222487e-10 1.0823713e-10 ] [ 1.5415596e-10 2.4253242e-10 2.9720573e-10 ] [ 4.070115e-10 2.2053809e-10 2.2753024e-10 ] [ 3.3776221e-10 2.2913373e-10 4.7062723e-10 ] [ 3.136839000000001e-10 4.3774679e-10 3.1739733e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.9e-06 7.7e-06 1.51e-05 ] [ 2.66e-05 -1.48e-05 2.4e-05 ] [ 5e-06 3.04e-05 -9e-07 ] [ -4.14e-05 2.9e-06 -2.78e-05 ] [ 1.67e-05 -2.62e-05 -1.04e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.105501868352e-14 1.233675998016e-14 2.419286697408e-14 ] [ 4.261789811328e-14 -2.371221398784e-14 3.84522388992e-14 ] [ 8.010883104e-15 4.870616927232e-14 -1.44195895872e-15 ] [ -6.633011210111999e-14 4.646312200320001e-15 -4.454051005824e-14 ] [ 2.675634956736e-14 -4.197702746496e-14 -1.666263685632e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.808942 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.693089389278319e-18 } }