{ "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" [ [ 0.8760834 0.5811476 0.1887226 ] [ 0.0667642 0.1957144 2.535937 ] [ 2.950388 1.045755 1.267551 ] [ 1.713434 2.554048 0.6359242 ] [ 2.757437 2.623078 2.535254 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.760833999999999e-11 5.811476e-11 1.887226e-11 ] [ 6.67642e-12 1.957144e-11 2.535937e-10 ] [ 2.950388e-10 1.045755e-10 1.267551e-10 ] [ 1.713434e-10 2.554048e-10 6.359242000000001e-11 ] [ 2.757437e-10 2.623078e-10 2.535254e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.058446 -2.166002 3.0882365 ] [ 3.2130899 1.9191938 -4.4795734 ] [ 2.0321967 -6.501037 -0.5725947 ] [ -3.3213957 4.050755 -2.3295792 ] [ 0.1345549 2.6970902 4.2935107 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.297994056379277e-09 -3.470317765006042e-09 4.947900319801219e-09 ] [ 5.14793751830861e-09 3.074887437144311e-09 -7.177067772637566e-09 ] [ 3.255938041606912e-09 -1.041580949235577e-08 -9.173978415339897e-10 ] [ -5.32146253896565e-09 6.490024957588703e-09 -3.732397330541967e-09 ] [ 2.155807149940819e-10 4.321214862628796e-09 6.878962464694641e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.751783 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.043060859611489e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.6406593 0.6821909 0.2518023 ] [ 0.8613922 0.4420204 2.6154758 ] [ 2.8921619 0.6709609 1.2447507 ] [ 1.8745925 2.7223652 0.3438388 ] [ 2.0953006 2.4822056 2.7075212 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.406593000000001e-11 6.821909e-11 2.518023e-11 ] [ 8.613922000000001e-11 4.420204e-11 2.6154758e-10 ] [ 2.8921619e-10 6.709609e-11 1.2447507e-10 ] [ 1.8745925e-10 2.7223652e-10 3.438388e-11 ] [ 2.0953006e-10 2.4822056e-10 2.7075212e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.19e-05 -1.7e-05 -4.93e-05 ] [ -1.42e-05 -2.26e-05 2.11e-05 ] [ -1.4e-06 -4.2e-06 -3.02e-05 ] [ 6.6e-06 -2.35e-05 2.16e-05 ] [ 2.09e-05 6.74e-05 3.68e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.906590178752e-14 -2.72370025536e-14 -7.898730740544e-14 ] [ -2.275090801536e-14 -3.620919163008e-14 3.380592669888e-14 ] [ -2.24304726912e-15 -6.72914180736e-15 -4.838573394816e-14 ] [ 1.057436569728e-14 -3.76511505888e-14 3.460701500928e-14 ] [ 3.348549137472e-14 1.0798670424192e-13 5.896009964544001e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.28693 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.609453847060615e-18 } }