{ "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" [ [ -0.2300443 -0.1125105 0.3703429 ] [ -1.6119902 1.3911425 -3.3757527 ] [ 0.1528452 -2.1383922 0.1579356 ] [ 0.7751916 1.9405631 -0.0401488 ] [ 0.9139978 -1.0808028 2.8876229 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.685715992083014e-10 -1.802616926945184e-10 5.933547360592722e-10 ] [ -2.582693011398716e-09 2.228855989701264e-09 -5.408552053542476e-09 ] [ 2.448850060415002e-10 -3.426081988941078e-09 2.530407259120205e-10 ] [ 1.241993858160545e-09 3.109124830007172e-09 -6.432546871317503e-11 ] [ 1.464385906622634e-09 -1.731636977855178e-09 4.626481900066697e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.2455554 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.481301270819119e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7155788 2.543492 2.7867567 ] [ 2.9330677 4.0457429 -0.4644176 ] [ 3.0395678 2.1166191 0.7879798 ] [ 3.8372989 5.2964855 1.2940147 ] [ 3.9815888 3.4195815 2.6198248 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7155788e-10 2.543492e-10 2.7867567e-10 ] [ 2.9330677e-10 4.0457429e-10 -4.644176e-11 ] [ 3.0395678e-10 2.1166191e-10 7.879798e-11 ] [ 3.8372989e-10 5.296485500000001e-10 1.2940147e-10 ] [ 3.9815888e-10 3.4195815e-10 2.6198248e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.36e-05 -8.1e-06 -1.87e-05 ] [ 7.6e-06 3.23e-05 1.82e-05 ] [ -5.7e-06 -1.32e-05 3.81e-05 ] [ -9e-07 -1.22e-05 -2.07e-05 ] [ -1.46e-05 1.2e-06 -1.69e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.178960204288e-14 -1.297763062848e-14 -2.996070280896e-14 ] [ 1.217654231808e-14 5.175030485184e-14 2.915961449856e-14 ] [ -9.13240673856e-15 -2.114873139456e-14 6.104292925248e-14 ] [ -1.44195895872e-15 -1.954655477376e-14 -3.316505605055999e-14 ] [ -2.339177866368e-14 1.92261194496e-15 -2.707678489152e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.457994 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.675555348726667e-18 } }