{ "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" [ [ 2.619068 2.165174 1.589354 ] [ 4.694039 1.985014 2.658467 ] [ 3.289805 2.94692 4.226906 ] [ 3.352089 4.483007 2.429606 ] [ 5.033516 4.030044 3.913159 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.619068e-10 2.165174e-10 1.589354e-10 ] [ 4.694039000000001e-10 1.985014e-10 2.658467e-10 ] [ 3.289805e-10 2.94692e-10 4.226906e-10 ] [ 3.352089e-10 4.483007e-10 2.429606e-10 ] [ 5.033516e-10 4.030044e-10 3.913159e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.8576594 -1.988358 -4.4639119 ] [ 6.5964106 -10.3514136 -3.4720539 ] [ -6.8038388 -3.2689419 10.3955229 ] [ -5.1642312 10.1969593 -5.9836843 ] [ 8.2293188 5.4117543 3.5241272 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.578475080889356e-09 -3.185700701380647e-09 -7.151975283490908e-09 ] [ 1.05686148445173e-08 -1.658479286215116e-08 -5.562843584737461e-09 ] [ -1.090095145705193e-08 -5.237422286933531e-09 1.665546375137102e-08 ] [ -8.274010493045928e-09 1.633732979370913e-08 -9.586919091708015e-09 ] [ 1.318482218646991e-08 8.67058621697387e-09 5.646274208565366e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 1.3407794 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.148165408330251e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.6216368 2.3272571 2.0887645 ] [ 5.1287644 1.8743168 2.3075727 ] [ 2.8360532 2.7404453 4.6031231 ] [ 3.4282931 4.7513327 1.9797983 ] [ 4.9737695 3.9168071 3.8382333 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6216368e-10 2.3272571e-10 2.0887645e-10 ] [ 5.1287644e-10 1.8743168e-10 2.3075727e-10 ] [ 2.8360532e-10 2.7404453e-10 4.6031231e-10 ] [ 3.4282931e-10 4.7513327e-10 1.9797983e-10 ] [ 4.973769500000001e-10 3.9168071e-10 3.8382333e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4e-07 -5.3e-06 -9.5e-06 ] [ -3.4e-06 9e-07 -1.6e-06 ] [ -1.4e-06 -1.2e-06 1.29e-05 ] [ 9e-07 4.2e-06 -4.7e-06 ] [ 3.5e-06 1.4e-06 2.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.408706483200001e-16 -8.491536090240001e-15 -1.52206778976e-14 ] [ -5.44740051072e-15 1.44195895872e-15 -2.56348259328e-15 ] [ -2.24304726912e-15 -1.92261194496e-15 2.066807840832e-14 ] [ 1.44195895872e-15 6.72914180736e-15 -7.53023011776e-15 ] [ 5.6076181728e-15 2.24304726912e-15 4.48609453824e-15 ] ] } "relaxed-potential-energy" { "source-value" -6.4498528 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.033380336376142e-18 } }