{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.336271 1.731327 1.289714 ] [ 2.769645 4.287083 1.737277 ] [ 4.480326 1.077167 0.108092 ] [ 5.392167 2.307543 2.197028 ] [ 3.12468 2.46702 3.187134 ] [ 4.416093 3.533887 0.3236582 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.336271e-10 1.731327e-10 1.289714e-10 ] [ 2.769645e-10 4.287083e-10 1.737277e-10 ] [ 4.480326e-10 1.077167e-10 1.08092e-11 ] [ 5.392167e-10 2.307543e-10 2.197028e-10 ] [ 3.12468e-10 2.467020000000001e-10 3.187134e-10 ] [ 4.416093e-10 3.533887e-10 3.236582e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0884951 -1.6248483 -2.7635379 ] [ -0.7260799 -0.5070903 0.030516 ] [ -0.9220081 1.4820035 1.5671779 ] [ -1.1985282 -0.2833114 -0.7030539 ] [ 2.1081502 0.8765194 2.4776728 ] [ 1.8269612 0.0567271 -0.608775 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.743961401075358e-09 -2.603293958606624e-09 -4.427675814074729e-09 ] [ -1.163308240612802e-09 -8.124482232944583e-10 4.88920217603328e-11 ] [ -1.477219822008228e-09 2.374431359643773e-09 2.510895792014441e-09 ] [ -1.920253861409507e-09 -4.539149014861171e-10 -1.126416521742261e-09 ] [ 3.377628963574844e-09 1.404338890357643e-09 3.969669434152075e-09 ] [ 2.927114521748713e-09 9.08868333857837e-11 -9.753650723275198e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -17.673312 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.831576729850409e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1910593 1.6506744 1.3114823 ] [ 2.6413479 4.0063092 1.4792782 ] [ 4.2565749 1.3323608 0.2375675 ] [ 5.394419 2.2041746 2.1676399 ] [ 3.3289035 2.5225197 3.2415409 ] [ 4.7068773 3.6879882 0.4053944 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1910593e-10 1.6506744e-10 1.3114823e-10 ] [ 2.6413479e-10 4.0063092e-10 1.4792782e-10 ] [ 4.2565749e-10 1.3323608e-10 2.375675e-11 ] [ 5.394419e-10 2.2041746e-10 2.1676399e-10 ] [ 3.3289035e-10 2.5225197e-10 3.2415409e-10 ] [ 4.706877300000001e-10 3.6879882e-10 4.053944e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.81e-05 2.79e-05 -9.9e-06 ] [ 4.4e-06 -6.5e-06 2.51e-05 ] [ -6e-07 -2.67e-05 9.1e-06 ] [ 2.7e-06 9.5e-06 -9e-06 ] [ -2.05e-05 -2.7e-06 -1.02e-05 ] [ -1.4e-05 -1.5e-06 -5.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.502116304448e-14 4.470072772032e-14 -1.586154854592e-14 ] [ 7.04957713152e-15 -1.04141480352e-14 4.021463318208e-14 ] [ -9.6130597248e-16 -4.277811577536e-14 1.457980724928e-14 ] [ 4.32587687616e-15 1.52206778976e-14 -1.44195895872e-14 ] [ -3.28446207264e-14 -4.32587687616e-15 -1.634220153216e-14 ] [ -2.24304726912e-14 -2.4032649312e-15 -8.33131842816e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.816992 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.014814465618063e-18 } }