{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.6079 1.726733 2.75301 ] [ 2.002918 3.986459 1.396167 ] [ 4.133267 4.619556 1.499098 ] [ 3.466505 3.469363 3.287809 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6079e-10 1.726733e-10 2.75301e-10 ] [ 2.002918e-10 3.986459e-10 1.396167e-10 ] [ 4.133267e-10 4.619556e-10 1.499098e-10 ] [ 3.466505e-10 3.469363e-10 3.287809000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1666165 -0.5167451 -0.1096147 ] [ -6.2122791 0.3659104 -3.8470634 ] [ 4.2967797 2.3925313 -2.5187778 ] [ 2.0821158 -2.2416966 6.4754559 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.66949063138861e-10 -8.279169249539932e-10 -1.756221110829198e-10 ] [ -9.953168417906548e-09 5.862530930175936e-10 -6.163675088996595e-09 ] [ 6.884200036785529e-09 3.833257744973643e-09 -4.035526937397925e-09 ] [ 3.335917284042217e-09 -3.591593913037244e-09 1.037482413747744e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -5.6204294 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.004920657726639e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.6521638 2.1829199 2.8031085 ] [ 1.7141895 3.8134449 0.8419442 ] [ 3.9531156 4.718159 1.6649519 ] [ 3.8911211 3.0875872 3.6260795 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6521638e-10 2.1829199e-10 2.8031085e-10 ] [ 1.7141895e-10 3.8134449e-10 8.419442e-11 ] [ 3.9531156e-10 4.718159e-10 1.6649519e-10 ] [ 3.8911211e-10 3.0875872e-10 3.6260795e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.5e-06 -1.07e-05 5.4e-06 ] [ 8.5e-06 1e-05 5.8e-06 ] [ -5e-07 -3e-07 -1.08e-05 ] [ -1.14e-05 1e-06 -4e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.607618218999999e-15 -1.71432899838e-14 8.6517538236e-15 ] [ 1.3618501389e-14 1.602176634e-14 9.2926244772e-15 ] [ -8.010883169999999e-16 -4.806529901999999e-16 -1.73035076472e-14 ] [ -1.82648136276e-14 1.602176634e-15 -6.408706536e-16 ] ] } "relaxed-potential-energy" { "source-value" -8.6094174 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.379380739063303e-18 } }