{ "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" [ [ 1.84187 2.347102 1.383115 ] [ 2.042679 1.03426 3.627522 ] [ 0.9834518 3.478775 3.226301 ] [ 4.103178 1.51668 2.106844 ] [ 3.482715 3.397853 2.716774 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.84187e-10 2.347102e-10 1.383115e-10 ] [ 2.042679e-10 1.03426e-10 3.627522e-10 ] [ 9.834518e-11 3.478775e-10 3.226301e-10 ] [ 4.103178e-10 1.51668e-10 2.106844e-10 ] [ 3.482715e-10 3.397853e-10 2.716774e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0260999 -1.5846223 -2.2396676 ] [ 0.6132097 2.299199 -1.2082188 ] [ 0.2106945 -0.5626066 1.4014606 ] [ 1.1691488 -5.2361162 -0.9525218 ] [ -0.9669532 5.0841461 2.9989476 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.643993270385218e-09 -2.538844801858324e-09 -3.588343067083246e-09 ] [ 9.824702449877817e-10 3.68372288436674e-09 -1.935779914171031e-09 ] [ 3.375698020311457e-10 -9.013951412277772e-10 2.245387408292341e-09 ] [ 1.873182873596375e-09 -8.389182959432137e-09 -1.526108158762333e-09 ] [ -1.549229810447746e-09 8.1457000181515e-09 4.80484373172427e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.178846 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.27170155711236e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8745246 2.2719172 1.2437171 ] [ 2.1867734 1.2998273 3.6385098 ] [ 0.9350597 3.4217713 3.2480047 ] [ 4.0464979 1.2880967 1.9762177 ] [ 3.4110383 3.4930575 2.9541067 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8745246e-10 2.2719172e-10 1.2437171e-10 ] [ 2.1867734e-10 1.2998273e-10 3.6385098e-10 ] [ 9.350597000000001e-11 3.4217713e-10 3.2480047e-10 ] [ 4.0464979e-10 1.2880967e-10 1.9762177e-10 ] [ 3.4110383e-10 3.4930575e-10 2.9541067e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3e-07 1e-07 -2e-07 ] [ -1e-07 -2e-07 3e-07 ] [ -1.4e-06 9e-07 5e-07 ] [ 1.6e-06 -1e-06 -6e-07 ] [ 2e-07 2e-07 1e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.8065298624e-16 1.6021766208e-16 -3.2043532416e-16 ] [ -1.6021766208e-16 -3.2043532416e-16 4.8065298624e-16 ] [ -2.24304726912e-15 1.44195895872e-15 8.010883104e-16 ] [ 2.56348259328e-15 -1.6021766208e-15 -9.6130597248e-16 ] [ 3.2043532416e-16 3.2043532416e-16 1.6021766208e-16 ] ] } "relaxed-potential-energy" { "source-value" -15.840953 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.538000454779163e-18 } }