{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -6.540591e-11 3.905120000000001e-12 3.2244841e-10 ] [ 6.778402e-11 4.5401006e-10 -1.916586e-11 ] [ 8.2136e-11 4.9109242e-10 5.3072561e-10 ] [ 3.7143687e-10 -4.785971e-11 -7.6856e-12 ] [ 4.8471691e-10 5.722287000000001e-11 5.2182477e-10 ] [ 6.183254700000001e-10 4.4361286e-10 -7.040960000000001e-12 ] [ 6.2263043e-10 5.9256057e-10 5.2238882e-10 ] ] "source-value" [ [ -0.6540591 0.0390512 3.2244841 ] [ 0.6778402 4.5401006 -0.1916586 ] [ 0.82136 4.9109242 5.3072561 ] [ 3.7143687 -0.4785971 -0.076856 ] [ 4.8471691 0.5722287 5.2182477 ] [ 6.1832547 4.4361286 -0.0704096 ] [ 6.2263043 5.9256057 5.2238882 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -4.8065298624e-16 -6.408706483200001e-16 0.0 ] [ 0.0 0.0 0.0 ] [ -4.8065298624e-16 4.8065298624e-16 3.2043532416e-16 ] [ 1.6021766208e-16 -4.8065298624e-16 -3.2043532416e-16 ] [ 0.0 0.0 0.0 ] [ 1.6021766208e-16 3.2043532416e-16 -1.6021766208e-16 ] [ 6.408706483200001e-16 1.6021766208e-16 1.6021766208e-16 ] ] "source-value" [ [ -3e-07 -4e-07 -0.0 ] [ 0.0 0.0 0.0 ] [ -3e-07 3e-07 2e-07 ] [ 1e-07 -3e-07 -2e-07 ] [ 0.0 0.0 0.0 ] [ 1e-07 2e-07 -1e-07 ] [ 4e-07 1e-07 1e-07 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 4.565755560914486e-31 "source-value" 2.8497205e-12 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -4.038452959312625e-09 -2.860311126673809e-09 8.236349408962081e-10 ] [ -3.227087006325518e-09 2.725010835835814e-09 -3.680729537786098e-09 ] [ -3.39034976529101e-09 2.952798053850785e-09 3.382150786651728e-09 ] [ 9.440583809394259e-10 -4.649893065067488e-09 -3.45431746796476e-09 ] [ 2.830533712870268e-09 -3.665238092039584e-09 3.677638458431589e-09 ] [ 3.745699882589146e-09 2.123555815217102e-09 -3.265089354029597e-09 ] [ 3.135597754530313e-09 3.374077739094841e-09 2.516712173800931e-09 ] ] "source-value" [ [ -2.5206041 -1.7852658 0.5140725 ] [ -2.0141893 1.700818 -2.2973307 ] [ -2.1160899 1.8429916 2.1109725 ] [ 0.5892349 -2.902235 -2.1560154 ] [ 1.7666802 -2.2876617 2.2954014 ] [ 2.337882 1.3254193 -2.0379085 ] [ 1.9570862 2.1059337 1.5708082 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 2.504585779611082e-18 "source-value" 15.632395 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.173582e-10 1.448006e-10 2.849718e-10 ] [ 1.983285e-10 3.621531e-10 1.348175e-10 ] [ 2.327062e-10 3.623818e-10 3.682153e-10 ] [ 3.341801e-10 1.495458e-10 1.660386e-10 ] [ 3.963915e-10 2.011825e-10 3.715692e-10 ] [ 4.47485e-10 3.510245e-10 1.32465e-10 ] [ 4.551743e-10 4.234559e-10 4.054178000000001e-10 ] ] "source-value" [ [ 1.173582 1.448006 2.849718 ] [ 1.983285 3.621531 1.348175 ] [ 2.327062 3.623818 3.682153 ] [ 3.341801 1.495458 1.660386 ] [ 3.963915 2.011825 3.715692 ] [ 4.47485 3.510245 1.32465 ] [ 4.551743 4.234559 4.054178 ] ] } "instance-id" 1 }