{ "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" [ [ 1.239329 2.983674 3.512225 ] [ 2.999663 5.449943 1.062375 ] [ 1.178907 3.936124 1.554887 ] [ 2.122325 5.087093 3.38156 ] [ 3.136296 3.082629 1.288456 ] [ 5.117946 4.70791 1.219676 ] [ 3.839933 3.58316 3.463374 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.239329e-10 2.983674e-10 3.512225e-10 ] [ 2.999663e-10 5.449943e-10 1.062375e-10 ] [ 1.178907e-10 3.936124e-10 1.554887e-10 ] [ 2.122325e-10 5.087093000000001e-10 3.38156e-10 ] [ 3.136296e-10 3.082629e-10 1.288456e-10 ] [ 5.117946e-10 4.70791e-10 1.219676e-10 ] [ 3.839933e-10 3.58316e-10 3.463374e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.0156972 -1.1604709 1.5079744 ] [ -0.6152224 1.1858295 -0.2728783 ] [ -2.4421992 0.9746948 -1.8382636 ] [ -0.1433468 1.8581835 0.8231018 ] [ 2.4510043 -1.5932905 -1.0907822 ] [ -0.3942986 -0.9735793 0.8997604 ] [ 1.1597598 -0.2913671 -0.0289125 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.514968685202176e-11 -1.859279345098735e-09 2.416041328444907e-09 ] [ -9.85694945872466e-10 1.899908301154954e-09 -4.371992325836487e-10 ] [ -3.912834461576464e-09 1.561633220975332e-09 -2.945222962787643e-09 ] [ -2.296668916264934e-10 2.977138160856317e-09 1.318754460498397e-09 ] [ 3.92694178694027e-09 -2.552732789242743e-09 -1.74762573922479e-09 ] [ -6.317359985341709e-10 -1.559845992954829e-09 1.441575077201656e-09 ] [ 1.858140037303684e-09 -4.668215556902957e-10 -4.632293154888001e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -20.919569 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.351684436901244e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3909077 3.4062918 3.3753931 ] [ 2.5356827 5.7420802 1.3359102 ] [ 1.3930319 3.6952427 1.0705199 ] [ 2.5260896 5.440025 3.6390867 ] [ 3.4163451 2.5597629 1.1837594 ] [ 4.5516585 4.5934379 1.4473252 ] [ 3.8206835 3.3936926 3.4305584 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3909077e-10 3.4062918e-10 3.3753931e-10 ] [ 2.5356827e-10 5.7420802e-10 1.3359102e-10 ] [ 1.3930319e-10 3.6952427e-10 1.0705199e-10 ] [ 2.5260896e-10 5.440025000000001e-10 3.6390867e-10 ] [ 3.4163451e-10 2.5597629e-10 1.1837594e-10 ] [ 4.551658500000001e-10 4.5934379e-10 1.4473252e-10 ] [ 3.8206835e-10 3.3936926e-10 3.4305584e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.9e-05 -4e-07 -2e-07 ] [ 1.6e-06 1.66e-05 6.3e-06 ] [ -6.4e-06 -2.9e-05 2e-06 ] [ 4.5e-06 2.35e-05 2.68e-05 ] [ 4e-06 -2.55e-05 -1.06e-05 ] [ 2.65e-05 1.3e-05 -7.3e-06 ] [ -1.13e-05 1.8e-06 -1.69e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.04413557952e-14 -6.408706483200001e-16 -3.2043532416e-16 ] [ 2.56348259328e-15 2.659613190528e-14 1.009371271104e-14 ] [ -1.025393037312e-14 -4.64631220032e-14 3.2043532416e-15 ] [ 7.2097947936e-15 3.76511505888e-14 4.293833343744e-14 ] [ 6.4087064832e-15 -4.08555038304e-14 -1.698307218048e-14 ] [ 4.24576804512e-14 2.08282960704e-14 -1.169588933184e-14 ] [ -1.810459581504e-14 2.88391791744e-15 -2.707678489152e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.96247 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.678993258982137e-18 } }