{ "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" [ [ 0.9066893 0.9379891 0.1369545 ] [ 0.7550462 2.78121 2.963246 ] [ 2.797941 0.0158314 0.1688765 ] [ 2.09203 0.1495358 1.796908 ] [ 2.487588 2.015226 1.460751 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.066893000000001e-11 9.379891e-11 1.369545e-11 ] [ 7.550462e-11 2.78121e-10 2.963246e-10 ] [ 2.797941e-10 1.58314e-12 1.688765e-11 ] [ 2.09203e-10 1.495358e-11 1.796908e-10 ] [ 2.487588e-10 2.015226e-10 1.460751e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.7517593 2.7305003 -5.4203616 ] [ 0.5319535 -0.26968 0.1660623 ] [ 13.8332279 -5.0752536 -20.8021228 ] [ -9.1337272 -11.7361864 26.2456742 ] [ 3.5203051 14.3506197 -0.1892521 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.40218642568522e-08 4.37474377978999e-09 -8.684376703350854e-09 ] [ 8.522834680745189e-10 -4.320749946571199e-10 2.660611368482982e-10 ] [ 2.216327451417689e-08 -8.131452729544382e-09 -3.332867508775865e-08 ] [ -1.463384430117024e-08 -1.880344362234857e-08 4.205020594681664e-08 ] [ 5.640150575771033e-09 2.299222756676009e-08 -3.032152925554314e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -3.6534978 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.853548807530404e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.6926338 1.1820455 0.3455885 ] [ 0.7257167 2.2652817 2.5651411 ] [ 2.8900018 0.0946348 0.0455533 ] [ 1.9096264 0.1122647 2.3125918 ] [ 2.8213158 2.2455655 1.2578614 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.926338e-11 1.1820455e-10 3.455885e-11 ] [ 7.257167e-11 2.2652817e-10 2.5651411e-10 ] [ 2.8900018e-10 9.463480000000001e-12 4.55533e-12 ] [ 1.9096264e-10 1.122647e-11 2.3125918e-10 ] [ 2.8213158e-10 2.2455655e-10 1.2578614e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.8e-06 -2e-07 3e-06 ] [ -2.1e-06 -1.1e-06 -2.2e-06 ] [ -6.2e-06 8.3e-06 9.4e-06 ] [ 3.4e-06 1.5e-06 -6.4e-06 ] [ 1.1e-06 -8.4e-06 -3.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.088271209199999e-15 -3.204353268e-16 4.806529901999999e-15 ] [ -3.364570931399999e-15 -1.7623942974e-15 -3.5247885948e-15 ] [ -9.9334951308e-15 1.32980660622e-14 1.50604603596e-14 ] [ 5.4474005556e-15 2.403264951e-15 -1.02539304576e-14 ] [ 1.7623942974e-15 -1.34582837256e-14 -6.088271209199999e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.29999 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.291110984443366e-18 } }