{ "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" [ [ 2.581885 1.428418 2.998356 ] [ 2.14644 1.796808 5.429666 ] [ 2.773837 4.089142 2.091611 ] [ 4.654129 1.242937 4.425266 ] [ 3.536635 3.29537 4.044312 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.581885000000001e-10 1.428418e-10 2.998356e-10 ] [ 2.14644e-10 1.796808e-10 5.429666e-10 ] [ 2.773837e-10 4.089142e-10 2.091611e-10 ] [ 4.654129e-10 1.242937e-10 4.425266e-10 ] [ 3.536635e-10 3.29537e-10 4.044312e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.121739 -0.6580897 0.1011765 ] [ 0.1850786 0.0739876 -0.7511743 ] [ -0.6278366 -0.0090597 -1.1844285 ] [ -0.3150972 -0.3884395 -0.3234803 ] [ 0.8795943 0.9816013 2.1579066 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.950473796395712e-10 -1.054375931729286e-09 1.621026228743712e-10 ] [ 2.965286059303949e-10 1.185412029491021e-10 -1.203513901605805e-09 ] [ -1.005905122202561e-09 -1.451523953146176e-11 -1.897663651709213e-09 ] [ -5.048413671195418e-10 -6.223486854952416e-10 -5.182725739493702e-10 ] [ 1.409265423248942e-09 1.572698653806887e-09 3.457347504390017e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.750877 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.882698040329644e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.484293 1.3021398 2.8018327 ] [ 2.2441839 1.9036471 5.1343214 ] [ 2.7703654 3.5893752 2.3221467 ] [ 4.4230345 1.360308 4.2293747 ] [ 3.7710492 3.697205 4.5015355 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.484293e-10 1.3021398e-10 2.8018327e-10 ] [ 2.2441839e-10 1.9036471e-10 5.134321400000001e-10 ] [ 2.770365400000001e-10 3.5893752e-10 2.3221467e-10 ] [ 4.4230345e-10 1.360308e-10 4.2293747e-10 ] [ 3.7710492e-10 3.697205e-10 4.5015355e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.001076 0.1273997 0.1182374 ] [ 0.0122949 0.1659257 -0.0537055 ] [ 0.2210114 -0.0161493 0.403404 ] [ 0.0909229 0.2150051 -0.040864 ] [ -0.3253053 -0.4921811 -0.4270719 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.7239420439808e-12 2.041168208369338e-10 1.894371979841779e-10 ] [ 1.969860133507392e-11 2.658422773298746e-10 -8.604569650837441e-11 ] [ 3.540992980102771e-10 -2.587403090228544e-11 6.463244575372032e-10 ] [ 1.456745446753363e-10 3.444761445727661e-10 -6.54713454323712e-11 ] [ -5.211965462823303e-10 -7.885610516196268e-10 -6.842446135806356e-10 ] ] } "relaxed-potential-energy" { "source-value" -14.186838 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.272982016667703e-18 } }