{ "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" [ [ 2.298469 1.653345 1.333865 ] [ 0.8562694 1.609736 3.078689 ] [ 0.6106735 3.571622 1.917701 ] [ 2.573163 3.601998 2.791817 ] [ 3.634663 1.831744 3.381139 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.298469e-10 1.653345e-10 1.333865e-10 ] [ 8.562694e-11 1.609736e-10 3.078689e-10 ] [ 6.106735e-11 3.571622e-10 1.917701e-10 ] [ 2.573163e-10 3.601998e-10 2.791817e-10 ] [ 3.634663e-10 1.831744e-10 3.381139e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.7587481 -1.5405352 -2.5551377 ] [ -2.3996145 -1.6994533 1.9127357 ] [ -4.3693426 1.6490044 -1.5642062 ] [ 1.9774166 5.3473866 0.4483456 ] [ 3.0327924 -3.7564025 1.7582625 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.817825110911895e-09 -2.468209501294517e-09 -4.093781919592502e-09 ] [ -3.844606282507593e-09 -2.722824367834192e-09 3.064540445557634e-09 ] [ -7.000458619660808e-09 2.641996319043189e-09 -2.506134624397931e-09 ] [ 3.168170672203724e-09 8.567457863484704e-09 7.183288442767103e-10 ] [ 4.859069119052781e-09 -6.018420313399185e-09 2.817047093938425e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.7498346 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.241660391348474e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6412011 -0.2209752 1.4087284 ] [ 0.1948407 1.5338877 1.7190717 ] [ 0.7099006 3.6048522 2.5638612 ] [ 2.7561899 4.303808 3.3332859 ] [ 4.6711056 3.0468723 3.4782638 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6412011e-10 -2.209752e-11 1.4087284e-10 ] [ 1.948407e-11 1.5338877e-10 1.7190717e-10 ] [ 7.099006e-11 3.6048522e-10 2.5638612e-10 ] [ 2.7561899e-10 4.303808e-10 3.3332859e-10 ] [ 4.6711056e-10 3.0468723e-10 3.4782638e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.6e-06 -1.35e-05 -6.8e-06 ] [ -4.3e-06 1.8e-06 -1.5e-06 ] [ 1.65e-05 -1.4e-05 1e-07 ] [ -2.33e-05 3.7e-05 6e-06 ] [ 2.06e-05 -1.12e-05 2.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.53808956864e-14 -2.162938455899999e-14 -1.08948011112e-14 ] [ -6.8893595262e-15 2.8839179412e-15 -2.403264951e-15 ] [ 2.6435914461e-14 -2.243047287599999e-14 1.602176634e-16 ] [ -3.733071557219999e-14 5.9280535458e-14 9.613059803999999e-15 ] [ 3.300483866039999e-14 -1.79443783008e-14 3.5247885948e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.663724 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.708516942422502e-18 } }