{ "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" [ [ 0.4656555 2.854978 2.130075 ] [ 2.415045 0.7163998 1.216409 ] [ 1.531563 1.029003 2.475027 ] [ 2.019704 2.428405 0.6522284 ] [ 2.764103 2.749341 2.416687 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.656555e-11 2.854978e-10 2.130075e-10 ] [ 2.415045e-10 7.163998000000001e-11 1.216409e-10 ] [ 1.531563e-10 1.029003e-10 2.475027e-10 ] [ 2.019704e-10 2.428405e-10 6.522284e-11 ] [ 2.764103e-10 2.749341e-10 2.416687e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -12.4581833 8.6682809 3.0413986 ] [ 30.4075597 -28.4869411 -36.09429 ] [ -29.4553398 -7.2460046 43.8251981 ] [ -2.7920622 14.1249641 -25.1061561 ] [ 14.2980256 12.9397007 14.3338494 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.996021002090099e-08 1.388811700050718e-08 4.872857731453851e-09 ] [ 4.871828124692026e-08 -4.564111102852663e-08 -5.782942758237523e-08 ] [ -4.719265678527975e-08 -1.160937916432926e-08 7.021570779774858e-08 ] [ -4.473376780659414e-09 2.263068725065932e-08 -4.022449634157531e-08 ] [ 2.29079623399199e-08 2.073168594168939e-08 2.296535839474811e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 16.172711 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.591153945915499e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3215953 2.8191551 1.9985897 ] [ 2.2981435 0.3227058 0.789277 ] [ 1.5558893 0.8504251 3.0700323 ] [ 2.2171032 2.7243195 0.2823643 ] [ 2.8033392 3.0615212 2.750163 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.215953e-11 2.8191551e-10 1.9985897e-10 ] [ 2.2981435e-10 3.227058e-11 7.892770000000001e-11 ] [ 1.5558893e-10 8.504251000000001e-11 3.0700323e-10 ] [ 2.2171032e-10 2.7243195e-10 2.823643e-11 ] [ 2.8033392e-10 3.0615212e-10 2.750163e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.7e-06 -1.84e-05 -2.15e-05 ] [ -2.46e-05 2.63e-05 7e-06 ] [ 1.36e-05 -2.2e-06 8.2e-06 ] [ 1.6e-05 1.8e-06 3.25e-05 ] [ 4.7e-06 -7.5e-06 -2.62e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.554111322176e-14 -2.948004982272e-14 -3.44467973472e-14 ] [ -3.941354487168e-14 4.213724512704e-14 1.12152363456e-14 ] [ 2.178960204288e-14 -3.52478856576e-15 1.313784829056e-14 ] [ 2.56348259328e-14 2.88391791744e-15 5.207074017599999e-14 ] [ 7.53023011776e-15 -1.2016324656e-14 -4.197702746496e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.977047 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.758716806882278e-18 } }