{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.743488 1.903222 1.191758 ] [ 2.092285 1.109675 3.649357 ] [ 1.94045 3.241003 2.726585 ] [ 4.050079 0.1031898 2.277213 ] [ 5.000478 2.032764 2.106801 ] [ 4.158728 1.007331 4.48257 ] [ 3.981083 3.39009 3.613579 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.743488e-10 1.903222e-10 1.191758e-10 ] [ 2.092285e-10 1.109675e-10 3.649357e-10 ] [ 1.94045e-10 3.241003e-10 2.726585e-10 ] [ 4.050079e-10 1.031898e-11 2.277213e-10 ] [ 5.000478000000001e-10 2.032764e-10 2.106801e-10 ] [ 4.158728e-10 1.007331e-10 4.48257e-10 ] [ 3.981083e-10 3.39009e-10 3.613579e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 5.2290358 -13.4466871 -23.2751219 ] [ -23.5049988 -5.4267188 -6.260079 ] [ -22.5890368 19.0848413 10.798469 ] [ -16.5324095 -38.4811508 0.6579144 ] [ 25.1096852 29.7291744 -10.8094222 ] [ 22.4842035 1.5807549 15.2493986 ] [ 9.8035206 6.9597861 13.638841 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.377838908086225e-09 -2.154396769883295e-08 -3.729085615445008e-08 ] [ -3.765915954929205e-08 -8.694561989015831e-09 -1.002975221816104e-08 ] [ -3.619162664735084e-08 3.057728654253828e-08 1.730105457223356e-08 ] [ -2.648783998639182e-08 -6.165360015323923e-08 1.054095070167659e-09 ] [ 4.023015058308777e-08 4.763138817936587e-08 -1.73186035331965e-08 ] [ 3.602366518500953e-08 2.532648543995042e-09 2.443222991818025e-08 ] [ 1.570697150685119e-08 1.115080657518881e-08 2.185183218500849e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -7.9335275 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.271091228097387e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.64346 1.7576686 1.0080384 ] [ 1.7659289 0.8362806 3.4372638 ] [ 1.9180261 3.4158924 2.9227838 ] [ 4.186919 0.0089019 2.4501532 ] [ 5.1491706 2.3116312 1.6053338 ] [ 3.9779755 1.0819109 4.8474878 ] [ 4.325111 3.3749892 3.7768022 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.64346e-10 1.7576686e-10 1.0080384e-10 ] [ 1.7659289e-10 8.362806e-11 3.4372638e-10 ] [ 1.9180261e-10 3.4158924e-10 2.9227838e-10 ] [ 4.186919e-10 8.901900000000001e-13 2.4501532e-10 ] [ 5.149170599999999e-10 2.3116312e-10 1.6053338e-10 ] [ 3.9779755e-10 1.0819109e-10 4.847487799999999e-10 ] [ 4.325111e-10 3.3749892e-10 3.7768022e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.1e-06 -3.3e-06 -4.4e-06 ] [ -8.3e-06 8.2e-06 -1e-06 ] [ -7.6e-06 8.1e-06 7.7e-06 ] [ 4.9e-06 -1.47e-05 1e-06 ] [ 1.6e-06 8.2e-06 1.1e-06 ] [ 8.4e-06 -1e-07 1.9e-06 ] [ -5.1e-06 -6.5e-06 -6.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.77327738688e-15 -5.28718284864e-15 -7.04957713152e-15 ] [ -1.329806595264e-14 1.313784829056e-14 -1.6021766208e-15 ] [ -1.217654231808e-14 1.297763062848e-14 1.233675998016e-14 ] [ 7.850665441919999e-15 -2.355199632576e-14 1.6021766208e-15 ] [ 2.56348259328e-15 1.313784829056e-14 1.76239428288e-15 ] [ 1.345828361472e-14 -1.6021766208e-16 3.04413557952e-15 ] [ -8.17110076608e-15 -1.04141480352e-14 -1.025393037312e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.793262 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.972318472976905e-18 } }