{ "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" [ [ 1.84187 2.347102 1.383115 ] [ 2.042679 1.03426 3.627522 ] [ 0.9834518 3.478775 3.226301 ] [ 4.103178 1.51668 2.106844 ] [ 3.482715 3.397853 2.716774 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.84187e-10 2.347102e-10 1.383115e-10 ] [ 2.042679e-10 1.03426e-10 3.627522e-10 ] [ 9.834518e-11 3.478775e-10 3.226301e-10 ] [ 4.103178e-10 1.51668e-10 2.106844e-10 ] [ 3.482715e-10 3.397853e-10 2.716774e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.4324858 -2.3550093 3.1817935 ] [ 0.4335258 1.800331 -3.6329466 ] [ 3.7781564 -2.1974515 -0.3255007 ] [ -4.9811734 -2.7702784 -0.0708324 ] [ -2.6629947 5.5224083 0.8474862 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.499448545296797e-09 -3.773140873312695e-09 5.097795199913078e-09 ] [ 6.945849069961571e-10 2.884448261665854e-09 -5.820622155089743e-09 ] [ 6.053273903677557e-09 -3.520705447648251e-09 -5.215096158906437e-10 ] [ -7.980719631382336e-09 -4.438475322154905e-09 -1.134860162101416e-10 ] [ -4.266587884805839e-09 8.847873541667662e-09 1.357822587277451e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.480644046368852 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.358748973236339e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9065409 2.2695168 1.3171796 ] [ 2.194574 1.3513787 3.5843555 ] [ 1.0976304 3.3168236 3.1867522 ] [ 3.8910946 1.3941638 2.0532397 ] [ 3.3640539 3.4427871 2.919029 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9065409e-10 2.2695168e-10 1.3171796e-10 ] [ 2.194574e-10 1.3513787e-10 3.5843555e-10 ] [ 1.0976304e-10 3.316823600000001e-10 3.1867522e-10 ] [ 3.8910946e-10 1.3941638e-10 2.0532397e-10 ] [ 3.3640539e-10 3.4427871e-10 2.919029e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.62e-05 2.09e-05 0.0001435 ] [ 0.0001534 0.0004131 -0.0001302 ] [ 0.0004147 -0.0003162 -0.0002166 ] [ -0.0003631 0.00026 9.74e-05 ] [ -0.0002312 -0.0003778 0.0001059 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.197702781079999e-14 3.34854916506e-14 2.29912346979e-13 ] [ 2.457738956556e-13 6.618591675054e-13 -2.086033977468e-13 ] [ 6.644226501198e-13 -5.066082516707999e-13 -3.470314589243999e-13 ] [ -5.817503358054e-13 4.1656592484e-13 1.560520041516e-13 ] [ -3.704232377808e-13 -6.053023323251999e-13 1.696705055406e-13 ] ] } "relaxed-potential-energy" { "source-value" -12.92419804636885 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.070684812308062e-18 } }