{ "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" [ [ 0.4711414 1.535718 0.6051258 ] [ 0.1383881 2.176586 2.72717 ] [ 2.449817 0.7251628 0.0780297 ] [ 1.858809 0.1214998 2.575793 ] [ 2.444403 2.05802 2.37174 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.711414e-11 1.535718e-10 6.051258000000001e-11 ] [ 1.383881e-11 2.176586e-10 2.72717e-10 ] [ 2.449817e-10 7.251628e-11 7.80297e-12 ] [ 1.858809e-10 1.214998e-11 2.575793e-10 ] [ 2.444403e-10 2.05802e-10 2.37174e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.5392517 -0.1274819 4.8502819 ] [ 5.4690805 -2.9272945 -1.7751095 ] [ -0.1762134 0.6839856 5.9882882 ] [ -8.8466743 -16.5356514 -2.5649418 ] [ 1.0145554 18.9064423 -6.4985188 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.068329708066655e-09 -2.042485197551636e-10 7.771008264469403e-09 ] [ 8.762432914373175e-09 -4.690042810096426e-09 -2.844038940259978e-09 ] [ -2.823249897516787e-10 1.09586573728386e-09 9.594295352652514e-09 ] [ -1.417393473529221e-08 -2.649303408277879e-08 -4.10948978567267e-09 ] [ 1.625496942386393e-09 3.029145983556418e-08 -1.041177489118927e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -19.572568 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.135871085861822e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5934277 1.5277958 0.7588722 ] [ 0.331906 1.9673511 2.9143789 ] [ 2.613114 0.679443 0.4287626 ] [ 1.5083204 0.1978776 2.287617 ] [ 2.3157904 2.2445191 1.9682279 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.934277000000001e-11 1.5277958e-10 7.588722000000001e-11 ] [ 3.31906e-11 1.9673511e-10 2.9143789e-10 ] [ 2.613114e-10 6.79443e-11 4.287626e-11 ] [ 1.5083204e-10 1.978776e-11 2.287617e-10 ] [ 2.3157904e-10 2.2445191e-10 1.9682279e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.7e-05 -2.22e-05 7.74e-05 ] [ 8.23e-05 -1.56e-05 -1.3e-05 ] [ 6.18e-05 3.1e-06 1.62e-05 ] [ -7.35e-05 6.37e-05 -5.12e-05 ] [ -8.76e-05 -2.9e-05 -2.94e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.72370025536e-14 -3.556832098176e-14 1.2400847044992e-13 ] [ 1.3185913589184e-13 -2.499395528448e-14 -2.08282960704e-14 ] [ 9.901451516544e-14 4.96674752448e-15 2.595526125696e-14 ] [ -1.177599816288e-13 1.0205865074496e-13 -8.203144298496001e-14 ] [ -1.4035067198208e-13 -4.64631220032e-14 -4.710399265152e-14 ] ] } "relaxed-potential-energy" { "source-value" -28.867458 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.625076630952593e-18 } }