{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.175063 2.090387 1.108777 ] [ 2.290473 2.943113 3.7458 ] [ 1.562387 4.346014 1.227002 ] [ 3.205072 1.346551 2.036178 ] [ 4.414518 1.768723 4.119804 ] [ 3.44377 3.554925 2.238453 ] [ 4.008705 3.851776 5.027783 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.175063e-10 2.090387e-10 1.108777e-10 ] [ 2.290473e-10 2.943113e-10 3.7458e-10 ] [ 1.562387e-10 4.346014000000001e-10 1.227002e-10 ] [ 3.205072e-10 1.346551e-10 2.036178e-10 ] [ 4.414518e-10 1.768723e-10 4.119804e-10 ] [ 3.44377e-10 3.554925e-10 2.238453e-10 ] [ 4.008705e-10 3.851776e-10 5.027783000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.3935912 -0.7886083 -1.1317069 ] [ -12.4417264 4.2326885 6.1309708 ] [ -0.7266269 1.4819551 -1.1998717 ] [ 2.3197554 -9.4396986 -6.0850264 ] [ 1.5124428 4.9031318 -9.0244821 ] [ 10.4361359 -3.8763795 10.9147445 ] [ 1.2936104 3.486911 0.395372 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.834955860392617e-09 -1.263489781228833e-09 -1.813194336778044e-09 ] [ -1.993384316047015e-08 6.781514557829021e-09 9.822898078567474e-09 ] [ -1.164184631224379e-09 2.374353814295326e-09 -1.922406385699551e-09 ] [ 3.716657867854552e-09 -1.512406440431849e-08 -9.74928703503079e-09 ] [ 2.42320049445729e-09 7.855683138661021e-09 -1.445881423544809e-08 ] [ 1.672053295047157e-08 -6.210644608248394e-09 1.748734845990539e-08 ] [ 2.072592339303736e-09 5.586647283010349e-09 6.334557749189376e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -19.595627 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.139565544931724e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3939983 2.1246573 0.4577229 ] [ 2.172726 2.6381568 4.2817321 ] [ 1.544247 4.2496838 1.3387188 ] [ 2.7043556 1.2925756 2.2419991 ] [ 4.5617715 1.8166766 3.8838412 ] [ 3.5737245 3.655406 2.4262269 ] [ 4.1491651 4.1243329 4.8735559 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3939983e-10 2.1246573e-10 4.577229e-11 ] [ 2.172726e-10 2.6381568e-10 4.2817321e-10 ] [ 1.544247e-10 4.2496838e-10 1.3387188e-10 ] [ 2.7043556e-10 1.2925756e-10 2.2419991e-10 ] [ 4.5617715e-10 1.8166766e-10 3.8838412e-10 ] [ 3.5737245e-10 3.655406e-10 2.4262269e-10 ] [ 4.149165100000001e-10 4.1243329e-10 4.873555900000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.14e-05 -0.0001013 -3e-06 ] [ -7.12e-05 -0.0001342 -9.2e-05 ] [ 5.83e-05 0.0001111 8.8e-06 ] [ 2.87e-05 0.000127 0.0001534 ] [ -1.2e-05 6.79e-05 -3.75e-05 ] [ -3.43e-05 -3.28e-05 -3.63e-05 ] [ 5.19e-05 -3.77e-05 6.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.428657968511999e-14 -1.6230049168704e-13 -4.8065298624e-15 ] [ -1.1407497540096e-13 -2.1501210251136e-13 -1.474002491136e-13 ] [ 9.340689699264e-14 1.7800182257088e-13 1.409915426304e-14 ] [ 4.598246901696e-14 2.034764308416e-13 2.4577389363072e-13 ] [ -1.92261194496e-14 1.0878779255232e-13 -6.008162327999999e-14 ] [ -5.495465809344e-14 -5.255139316223999e-14 -5.815901133504e-14 ] [ 8.315296661952001e-14 -6.040205860416e-14 1.057436569728e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.941647 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.996092370764646e-18 } }