{ "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" [ [ 1.569029 2.409456 2.459016 ] [ 1.280031 0.1374919 2.779238 ] [ 3.588101 1.133333 2.932926 ] [ 4.931515 2.722575 2.426382 ] [ 3.330231 3.38172 3.93095 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.569029e-10 2.409456e-10 2.459016e-10 ] [ 1.280031e-10 1.374919e-11 2.779238e-10 ] [ 3.588101e-10 1.133333e-10 2.932926e-10 ] [ 4.931515000000001e-10 2.722575e-10 2.426382e-10 ] [ 3.330231e-10 3.38172e-10 3.93095e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5900939 0.3225516 0.4983351 ] [ 0.5120108 0.2659693 -0.0383317 ] [ -1.6740918 -1.7675999 0.5375976 ] [ 1.2774711 1.409082 -0.6551466 ] [ -0.705484 -0.230003 -0.3424544 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.45434650656693e-10 5.167846325216333e-10 7.984208465440301e-10 ] [ 8.203317333571046e-10 4.261297943105415e-10 -6.141415357551937e-11 ] [ -2.682190743032989e-09 -2.832007234708418e-09 8.613263061181901e-10 ] [ 2.046734330167659e-09 2.257598237190106e-09 -1.049660565716609e-09 ] [ -1.130309971148467e-09 -3.685054293138624e-10 -5.486724333700915e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.191893 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.953356592789517e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1014897 2.6956724 2.7176796 ] [ 1.6826502 0.4711723 2.4902215 ] [ 3.7724404 0.8825662 3.4116848 ] [ 4.9705936 2.5532804 2.2621328 ] [ 3.1717332 3.1818847 3.6467933 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1014897e-10 2.6956724e-10 2.7176796e-10 ] [ 1.6826502e-10 4.711723e-11 2.4902215e-10 ] [ 3.7724404e-10 8.825662e-11 3.4116848e-10 ] [ 4.9705936e-10 2.5532804e-10 2.2621328e-10 ] [ 3.1717332e-10 3.1818847e-10 3.6467933e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.3e-06 3e-07 -3e-07 ] [ 0.0 1.7e-06 2e-07 ] [ 1.5e-06 -7e-07 1e-06 ] [ 1.5e-06 1e-07 -7e-07 ] [ -8e-07 -1.3e-06 -2e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.68500622784e-15 4.8065298624e-16 -4.8065298624e-16 ] [ 0.0 2.72370025536e-15 3.2043532416e-16 ] [ 2.4032649312e-15 -1.12152363456e-15 1.6021766208e-15 ] [ 2.4032649312e-15 1.6021766208e-16 -1.12152363456e-15 ] [ -1.28174129664e-15 -2.08282960704e-15 -3.2043532416e-16 ] ] } "relaxed-potential-energy" { "source-value" -12.912293 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.06877739655195e-18 } }