{ "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" [ [ 2.539099 2.604661 3.099024 ] [ 2.611969 4.601789 1.586924 ] [ 4.376067 2.909228 1.297188 ] [ 4.596034 1.971363 3.954157 ] [ 4.509814 4.398854 3.387028 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.539099e-10 2.604661e-10 3.099024e-10 ] [ 2.611969e-10 4.601789e-10 1.586924e-10 ] [ 4.376067e-10 2.909228e-10 1.297188e-10 ] [ 4.596034e-10 1.971363e-10 3.954157e-10 ] [ 4.509814000000001e-10 4.398854e-10 3.387028e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.7939686 0.1783076 -0.6629682 ] [ -1.0951485 1.5443757 -0.1986625 ] [ 1.3865268 -1.4304505 -1.2092448 ] [ 3.2031895 -1.9159311 1.5979698 ] [ 0.2994008 1.6236984 0.4729057 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.078607790969306e-09 2.856802680309581e-10 -1.062192150373859e-09 ] [ -1.754621323004189e-09 2.474362640271634e-09 -3.1829241292968e-10 ] [ 2.221460823072637e-09 -2.291834348311671e-09 -1.937423747383972e-09 ] [ 5.132075328892042e-09 -3.069660015483627e-09 2.560229854304452e-09 ] [ 4.796929620088167e-10 2.601451615710367e-09 7.576784563830586e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -8.8326391 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.415144786598395e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8084286 2.4694835 2.5169046 ] [ 2.1816646 5.0349561 2.5307522 ] [ 4.7551327 2.5016423 0.7325327 ] [ 4.2429924 2.3549385 4.7313076 ] [ 4.6447647 4.1248747 2.8128238 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8084286e-10 2.4694835e-10 2.5169046e-10 ] [ 2.1816646e-10 5.0349561e-10 2.5307522e-10 ] [ 4.7551327e-10 2.5016423e-10 7.325327e-11 ] [ 4.242992400000001e-10 2.3549385e-10 4.7313076e-10 ] [ 4.6447647e-10 4.1248747e-10 2.8128238e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8e-07 -6e-07 0.0 ] [ 9e-07 -6e-07 1e-07 ] [ -1e-07 8e-07 1.1e-06 ] [ -0.0 6e-07 -9e-07 ] [ 1e-07 -2e-07 -3e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.28174129664e-15 -9.6130597248e-16 0.0 ] [ 1.44195895872e-15 -9.6130597248e-16 1.6021766208e-16 ] [ -1.6021766208e-16 1.28174129664e-15 1.76239428288e-15 ] [ 0.0 9.6130597248e-16 -1.44195895872e-15 ] [ 1.6021766208e-16 -3.2043532416e-16 -4.8065298624e-16 ] ] } "relaxed-potential-energy" { "source-value" -12.793383 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.049725914354017e-18 } }