{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.839564 1.867321 2.162261 ] [ 1.684665 2.737292 4.133334 ] [ 1.168876 4.298629 2.101191 ] [ 4.284365 2.457862 3.031672 ] [ 3.236614 0.5901118 4.309357 ] [ 3.135041 3.239997 1.121025 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.839564e-10 1.867321e-10 2.162261e-10 ] [ 1.684665e-10 2.737292e-10 4.133334e-10 ] [ 1.168876e-10 4.298629e-10 2.101191e-10 ] [ 4.284365e-10 2.457862e-10 3.031672e-10 ] [ 3.236614e-10 5.901118e-11 4.309357e-10 ] [ 3.135041e-10 3.239997e-10 1.121025e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.8812698 -0.9862362 0.0759619 ] [ -0.4621078 0.0137878 1.2703886 ] [ 2.898001 -1.5148961 -1.4670992 ] [ -3.8433371 2.0041356 -5.7543893 ] [ 0.344887 0.6146325 -0.420372 ] [ 1.9438266 -0.1314236 6.29551 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.411949870177092e-09 -1.580124582226633e-09 1.217043802515475e-10 ] [ -7.403783134493223e-10 2.209049081226624e-11 2.035386914250843e-09 ] [ 4.643109449255021e-09 -2.427131114361099e-09 -2.350552038634383e-09 ] [ -6.157704847473272e-09 3.210979203232981e-09 -9.219548003441676e-09 ] [ 5.525698882178495e-10 9.84749821883856e-10 -6.735101904389376e-10 ] [ 3.114353533409153e-09 -2.105638193413709e-10 1.008651893801261e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -5.6853594 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.108949911525517e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.549056 1.5000485 2.35426 ] [ 1.6180231 2.6773158 4.2079304 ] [ 1.1435526 4.5570707 1.4794367 ] [ 4.7702759 2.3532138 2.6048411 ] [ 3.2451738 0.6053665 4.2989237 ] [ 3.0230437 3.4981976 1.9134481 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.549056e-10 1.5000485e-10 2.35426e-10 ] [ 1.6180231e-10 2.6773158e-10 4.207930400000001e-10 ] [ 1.1435526e-10 4.5570707e-10 1.4794367e-10 ] [ 4.7702759e-10 2.3532138e-10 2.6048411e-10 ] [ 3.2451738e-10 6.053665000000001e-11 4.2989237e-10 ] [ 3.0230437e-10 3.4981976e-10 1.9134481e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 -0.0 -0.0 ] [ 0.0 0.0 0.0 ] [ 0.0040737 -0.0015393 -0.000414 ] [ 0.0042909 -0.001999 0.0002408 ] [ 0.0 0.0 0.0 ] [ -0.0083646 0.0035383 0.0001732 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 6.52678690015296e-12 -2.46623047239744e-12 -6.633011210111999e-13 ] [ 6.874779662190721e-12 -3.2027510649792e-12 3.8580413028864e-13 ] [ 0.0 0.0 0.0 ] [ -1.340156656234368e-11 5.66898153737664e-12 2.7749699072256e-13 ] ] } "relaxed-potential-energy" { "source-value" -8.5392133 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.368132790928442e-18 } }