{ "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" [ [ 2.819728 1.352428 1.364201 ] [ 2.130711 2.142985 3.535598 ] [ 2.900765 3.536828 2.247591 ] [ 4.867849 2.542824 1.805581 ] [ 4.180951 2.552465 4.619841 ] [ 3.604443 0.2919785 5.062878 ] [ 4.799237 0.5958561 3.34882 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.819728e-10 1.352428e-10 1.364201e-10 ] [ 2.130711e-10 2.142985e-10 3.535598e-10 ] [ 2.900765e-10 3.536828e-10 2.247591e-10 ] [ 4.867849e-10 2.542824e-10 1.805581e-10 ] [ 4.180951e-10 2.552465e-10 4.619841e-10 ] [ 3.604443e-10 2.919785e-11 5.062878e-10 ] [ 4.799237e-10 5.958561e-11 3.34882e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.590944 -7.3705278 -6.2021601 ] [ -11.6725819 -2.1485891 7.0845124 ] [ -1.6223424 12.4975698 -4.0334849 ] [ 8.5062302 1.2292032 -3.8466077 ] [ 2.9710894 6.1275056 6.6578254 ] [ -3.429438 -4.798456 5.9673718 ] [ 7.8379866 -5.5367058 -5.6274569 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.151149902602035e-09 -1.180888732411646e-08 -9.936955910678591e-09 ] [ -1.870153782455325e-08 -3.442419223725713e-09 1.13506401370477e-08 ] [ -2.599279064212562e-09 2.002331415037613e-08 -6.462355207129826e-09 ] [ 1.362848315758291e-08 1.969400629252546e-09 -6.162944926329261e-09 ] [ 4.760209974986699e-09 9.817346216141077e-09 1.066701220124841e-08 ] [ -5.494565386083111e-09 -7.687974019137484e-09 9.560783585581214e-09 ] [ 1.255783888466368e-08 -8.870780589007762e-09 -9.016179879739644e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.2803817 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.486881059184016e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5462488 0.307031 1.522069 ] [ 1.7152088 1.7718454 3.226892 ] [ 2.9895222 3.7591341 2.8133472 ] [ 5.2867186 2.6750575 2.3364716 ] [ 4.5655383 3.145287 4.7971344 ] [ 3.5207568 0.9841448 4.6771136 ] [ 4.6796905 0.3728648 2.6114823 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5462488e-10 3.07031e-11 1.522069e-10 ] [ 1.7152088e-10 1.7718454e-10 3.226892e-10 ] [ 2.9895222e-10 3.7591341e-10 2.8133472e-10 ] [ 5.2867186e-10 2.6750575e-10 2.3364716e-10 ] [ 4.5655383e-10 3.145287e-10 4.7971344e-10 ] [ 3.5207568e-10 9.841448000000001e-11 4.6771136e-10 ] [ 4.679690500000001e-10 3.728648e-11 2.6114823e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.9e-06 -1.3e-06 -2.56e-05 ] [ 1.05e-05 3e-06 -5.6e-06 ] [ -2.1e-06 2.9e-06 1.07e-05 ] [ -1.79e-05 -1.4e-06 1.7e-05 ] [ 4e-06 -2.9e-06 -2.65e-05 ] [ 9.8e-06 3.7e-06 1.53e-05 ] [ 3.6e-06 -4e-06 1.46e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.265719530432e-14 -2.08282960704e-15 -4.101572149248001e-14 ] [ 1.68228545184e-14 4.8065298624e-15 -8.972189076479999e-15 ] [ -3.36457090368e-15 4.646312200320001e-15 1.714328984256e-14 ] [ -2.867896151232001e-14 -2.24304726912e-15 2.72370025536e-14 ] [ 6.4087064832e-15 -4.646312200320001e-15 -4.24576804512e-14 ] [ 1.570133088384e-14 5.928053496960001e-15 2.451330229824e-14 ] [ 5.76783583488e-15 -6.4087064832e-15 2.339177866368e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.086282 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.057959479839587e-18 } }