{ "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" [ [ 0.4523459 0.4778673 0.765296 ] [ 0.8876723 1.989638 2.471047 ] [ 2.135329 1.164008 0.2412907 ] [ 2.495776 0.5844002 2.912252 ] [ 2.604983 2.71818 1.724062 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.523459e-11 4.778673e-11 7.65296e-11 ] [ 8.876723e-11 1.989638e-10 2.471047e-10 ] [ 2.135329e-10 1.164008e-10 2.412907e-11 ] [ 2.495776e-10 5.844002e-11 2.912252e-10 ] [ 2.604983e-10 2.71818e-10 1.724062e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -27.3599288 -9.1736782 7.9666614 ] [ -16.7347582 -1.6163975 7.4227647 ] [ 28.2318482 7.7531894 -17.3019236 ] [ 4.4995551 -10.3145591 9.2785738 ] [ 11.3632837 13.3514454 -7.3660763 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.383543863126365e-08 -1.469785285987518e-08 1.276399874606973e-08 ] [ -2.68120385636799e-08 -2.589754305756014e-09 1.189258016202002e-08 ] [ 4.523240752067496e-08 1.242197889565648e-08 -2.772073771517316e-08 ] [ 7.209082044615533e-09 -1.652574558003207e-08 1.486591413920459e-08 ] [ 1.820598762965307e-08 2.139137385000678e-08 -1.180175533212117e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -0.10233167 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.639534105921988e-20 } "relaxed-configuration-positions" { "source-value" [ [ 0.3417048 0.3487292 0.6975449 ] [ 1.0688145 1.7227221 2.633796 ] [ 2.1095385 1.6216538 -0.6930153 ] [ 2.2634247 0.2410042 4.091901 ] [ 2.7926236 2.9999842 1.3837211 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.417048e-11 3.487292e-11 6.975449e-11 ] [ 1.0688145e-10 1.7227221e-10 2.633796e-10 ] [ 2.1095385e-10 1.6216538e-10 -6.930153e-11 ] [ 2.2634247e-10 2.410042e-11 4.091901e-10 ] [ 2.7926236e-10 2.9999842e-10 1.3837211e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3e-07 -9.3e-06 6.6e-06 ] [ -2.01e-05 -1.9e-06 -4.8e-06 ] [ -4.2e-06 1.02e-05 -1.31e-05 ] [ 3.7e-06 -5.5e-06 1.41e-05 ] [ 2.08e-05 6.5e-06 -2.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.806529901999999e-16 -1.49002426962e-14 1.05743657844e-14 ] [ -3.22037503434e-14 -3.0441356046e-15 -7.690447843199998e-15 ] [ -6.729141862799999e-15 1.63422016668e-14 -2.09885139054e-14 ] [ 5.9280535458e-15 -8.811971486999999e-15 2.25906905394e-14 ] [ 3.332527398719999e-14 1.0414148121e-14 -4.3258769118e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.90107 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.227196954159838e-18 } }