{ "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" [ [ 1.62041 2.509202 2.566624 ] [ 2.85955 3.94705 0.1409863 ] [ 3.121365 1.927989 0.779992 ] [ 4.065015 5.453159 1.199522 ] [ 3.840762 3.584521 2.337034 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.62041e-10 2.509202e-10 2.566624e-10 ] [ 2.85955e-10 3.94705e-10 1.409863e-11 ] [ 3.121365e-10 1.927989e-10 7.79992e-11 ] [ 4.065015e-10 5.453159000000001e-10 1.199522e-10 ] [ 3.840762e-10 3.584521e-10 2.337034e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.6942351 -1.3566561 3.2745787 ] [ -4.2632512 3.7826137 -10.5992802 ] [ 0.5179636 -7.7094327 -2.4832857 ] [ 2.4695217 5.9606642 -0.0773667 ] [ 4.970001 -0.6771891 9.8853538 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.91881710895875e-09 -2.173602685885707e-09 5.246453436109657e-09 ] [ -6.830481401237545e-09 6.060415235657785e-09 -1.698191893374835e-08 ] [ 8.298691703454029e-10 -1.235187283157102e-08 -3.978662291306962e-09 ] [ 3.956609932298271e-09 9.550036825679536e-09 -1.239551179684474e-10 ] [ 7.96281940755262e-09 -1.084976543880593e-09 1.583808274669644e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -5.393867 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.641927603104634e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.4838251 2.108253 2.7190986 ] [ 3.1581532 3.9558689 -0.5385959 ] [ 2.1935614 2.020836 0.3868531 ] [ 4.044241 5.2393855 1.2217109 ] [ 3.6273213 4.0975775 3.2350915 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4838251e-10 2.108253e-10 2.7190986e-10 ] [ 3.1581532e-10 3.9558689e-10 -5.385959e-11 ] [ 2.1935614e-10 2.020836e-10 3.868531e-11 ] [ 4.044241000000001e-10 5.2393855e-10 1.2217109e-10 ] [ 3.6273213e-10 4.0975775e-10 3.2350915e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.26e-05 1.38e-05 -5.63e-05 ] [ -2.7e-06 5.9e-06 -2.9e-06 ] [ 2.46e-05 1.2e-05 5.45e-05 ] [ -2.23e-05 -3.64e-05 9.1e-06 ] [ 1.3e-05 4.7e-06 -4.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.018742542208e-14 2.211003736704e-14 -9.020254375104e-14 ] [ -4.32587687616e-15 9.45284206272e-15 -4.646312200320001e-15 ] [ 3.941354487168e-14 1.92261194496e-14 8.731862583360001e-14 ] [ -3.572853864384e-14 -5.831922899712e-14 1.457980724928e-14 ] [ 2.08282960704e-14 7.53023011776e-15 -7.04957713152e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.837104 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.736295466597816e-18 } }