{ "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" [ [ 1.173582 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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3804755 1.8052241 -0.9245597 ] [ -0.1392773 -1.315197 -0.171925 ] [ -2.8676814 0.6224332 0.7965256 ] [ -1.4774892 -1.6846208 -2.6288831 ] [ 2.5492645 -1.9992526 3.1911935 ] [ 0.2994708 2.1869963 3.3271916 ] [ 1.2552372 0.3844168 -3.5895428 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.095889508871905e-10 2.892287848324721e-09 -1.481307935873862e-09 ] [ -2.231468338681478e-10 -2.107177885146297e-09 -2.7545421553104e-10 ] [ -4.594532094983013e-09 9.972479210497305e-10 1.276174694188692e-09 ] [ -2.367198653724495e-09 -2.699060060673393e-09 -4.211935041636229e-09 ] [ 4.084371982135402e-09 -3.203155774793614e-09 5.112855618148924e-09 ] [ 4.798051143722727e-10 3.503954341636103e-09 5.330748594442145e-09 ] [ 2.011111695398454e-09 6.159036096027495e-10 -5.75108155352097e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.06531 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.214817057110445e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.247106 1.6626514 2.652937 ] [ 2.0244494 3.6050456 1.4198555 ] [ 2.1650341 3.5407153 3.9323327 ] [ 3.489179 1.5146197 1.7293338 ] [ 3.9344348 1.8281016 4.0828429 ] [ 4.4237055 3.7164556 1.2515989 ] [ 4.5323292 4.0778529 3.5660512 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.247106e-10 1.6626514e-10 2.652937e-10 ] [ 2.0244494e-10 3.6050456e-10 1.4198555e-10 ] [ 2.1650341e-10 3.5407153e-10 3.9323327e-10 ] [ 3.489179e-10 1.5146197e-10 1.7293338e-10 ] [ 3.9344348e-10 1.8281016e-10 4.0828429e-10 ] [ 4.4237055e-10 3.7164556e-10 1.2515989e-10 ] [ 4.532329200000001e-10 4.0778529e-10 3.5660512e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8.6e-06 -7.2e-06 1.13e-05 ] [ -5.4e-06 6.1e-06 2.7e-06 ] [ -2.1e-06 7.7e-06 7.5e-06 ] [ 2.34e-05 1.36e-05 8e-06 ] [ -2.64e-05 -7.5e-06 -2.92e-05 ] [ -7e-07 -2.02e-05 -4.1e-06 ] [ 2.6e-06 7.5e-06 3.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.377871893888e-14 -1.153567166976e-14 1.810459581504e-14 ] [ -8.65175375232e-15 9.77327738688e-15 4.32587687616e-15 ] [ -3.36457090368e-15 1.233675998016e-14 1.2016324656e-14 ] [ 3.749093292672001e-14 2.178960204288e-14 1.28174129664e-14 ] [ -4.229746278912e-14 -1.2016324656e-14 -4.678355732736e-14 ] [ -1.12152363456e-15 -3.236396774016e-14 -6.568924145279999e-15 ] [ 4.16565921408e-15 1.2016324656e-14 6.08827115904e-15 ] ] } "relaxed-potential-energy" { "source-value" -22.055691 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.533711247578897e-18 } }