{ "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" [ [ 1.875325 2.956791 1.293332 ] [ 2.112421 5.47429 1.464888 ] [ 2.056962 4.106673 3.914817 ] [ 3.228113 2.011758 3.122182 ] [ 3.602336 4.040974 2.324239 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.875325e-10 2.956791e-10 1.293332e-10 ] [ 2.112421e-10 5.47429e-10 1.464888e-10 ] [ 2.056962e-10 4.106673e-10 3.914817000000001e-10 ] [ 3.228113e-10 2.011758e-10 3.122182e-10 ] [ 3.602336e-10 4.040974e-10 2.324239e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.4406098 -4.5078219 -6.793404 ] [ -3.0515428 5.1613369 -3.2922655 ] [ -5.2050521 2.2327896 9.6994565 ] [ 0.5326632 -9.2386798 3.3966072 ] [ 13.1645415 6.3523751 -3.0103943 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.716817896271412e-09 -7.222326918413484e-09 -1.088423315412213e-08 ] [ -4.889110571810934e-09 8.269373381381994e-09 -5.274790857024327e-09 ] [ -8.33941285337263e-09 3.577323325758206e-09 1.554024256679942e-08 ] [ 8.534205328316687e-10 -1.480199690456779e-08 5.441964690716164e-09 ] [ 2.109192078862331e-08 1.017762695562341e-08 -4.823183406586786e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.8935756 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.44254911703253e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.2353247 2.8509183 0.7932398 ] [ 1.7797209 5.4289203 1.214234 ] [ 2.4195315 4.1766596 4.6120973 ] [ 2.6774445 1.9856114 3.1411352 ] [ 3.7631353 4.1483764 2.3587517 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2353247e-10 2.8509183e-10 7.932398000000001e-11 ] [ 1.7797209e-10 5.4289203e-10 1.214234e-10 ] [ 2.4195315e-10 4.1766596e-10 4.6120973e-10 ] [ 2.6774445e-10 1.9856114e-10 3.1411352e-10 ] [ 3.7631353e-10 4.1483764e-10 2.3587517e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.7e-06 5e-07 -1.32e-05 ] [ -1.01e-05 5e-06 1.48e-05 ] [ -1.7e-05 -3.6e-06 6.4e-06 ] [ -7.3e-06 6e-07 2.34e-05 ] [ 2.77e-05 -2.5e-06 -3.13e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.07345834478e-14 8.010883169999999e-16 -2.11487315688e-14 ] [ -1.61819840034e-14 8.010883169999999e-15 2.37122141832e-14 ] [ -2.723700277799999e-14 -5.767835882399999e-15 1.02539304576e-14 ] [ -1.16958894282e-14 9.613059803999998e-16 3.749093323559999e-14 ] [ 4.438029276179999e-14 -4.005441585e-15 -5.014812864419999e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.498488 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.842260879992939e-18 } }