{ "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" [ [ 0.5094065 0.6220131 0.2703167 ] [ 0.4530106 0.160144 2.650194 ] [ 0.6482707 2.949508 2.588273 ] [ 2.962565 0.672996 2.425796 ] [ 1.742585 2.553059 0.6145101 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.094065e-11 6.220131e-11 2.703167e-11 ] [ 4.530106e-11 1.60144e-11 2.650194e-10 ] [ 6.482707e-11 2.949508e-10 2.588273e-10 ] [ 2.962565e-10 6.72996e-11 2.425796e-10 ] [ 1.742585e-10 2.553059e-10 6.145100999999999e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0250956 -0.1915116 0.739646 ] [ 1.2558466 1.3561866 -0.6891742 ] [ 0.0848117 -1.301107 0.0724985 ] [ -1.9239525 0.5623831 -0.5466078 ] [ 0.5581986 -0.425951 0.4236375 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.020758360494848e-11 -3.068354081320013e-10 1.185043528868237e-09 ] [ 2.012088061831169e-09 2.172850463962241e-09 -1.104178790898543e-09 ] [ 1.358833229103034e-10 -2.084603216559226e-09 1.161554017430688e-10 ] [ -3.082511715029712e-09 9.010370547530285e-10 -8.757622379069222e-10 ] [ 8.943327466832908e-10 -6.824487338063809e-10 6.7874209819416e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -3.7351303992349507 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.984338601293609e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.9120321 0.3867119 0.3865775 ] [ 0.2141377 0.4279596 2.6344723 ] [ 1.0140966 2.6321883 2.8423878 ] [ 2.4635799 0.9199196 2.0911592 ] [ 1.7119915 2.5909407 0.594493 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.120321000000001e-11 3.867119e-11 3.865775000000001e-11 ] [ 2.141377e-11 4.279596e-11 2.6344723e-10 ] [ 1.0140966e-10 2.6321883e-10 2.8423878e-10 ] [ 2.4635799e-10 9.199196e-11 2.0911592e-10 ] [ 1.7119915e-10 2.5909407e-10 5.944930000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.6e-06 3.3e-06 7.3e-06 ] [ -4.5e-06 -5.1e-06 3.3e-06 ] [ 6.2e-06 -5.9e-06 -5.1e-06 ] [ -9.2e-06 5.3e-06 -4.2e-06 ] [ 2e-06 2.4e-06 -1.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.972189076479999e-15 5.28718284864e-15 1.169588933184e-14 ] [ -7.2097947936e-15 -8.17110076608e-15 5.28718284864e-15 ] [ 9.93349504896e-15 -9.45284206272e-15 -8.17110076608e-15 ] [ -1.474002491136e-14 8.491536090240001e-15 -6.72914180736e-15 ] [ 3.2043532416e-15 3.84522388992e-15 -2.08282960704e-15 ] ] } "relaxed-potential-energy" { "source-value" -5.34072039923495 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.55677736188388e-19 } }