{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.5286717 0.5459164 0.2171681 ] [ 0.0530602 2.45185 0.0097729 ] [ 0.1982568 1.952172 2.366336 ] [ 2.940741 0.007829 0.5912968 ] [ 2.574768 0.9414562 2.330693 ] [ 2.158325 2.742494 1.504322 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.286717e-11 5.459164e-11 2.171681e-11 ] [ 5.30602e-12 2.45185e-10 9.7729e-13 ] [ 1.982568e-11 1.952172e-10 2.366336e-10 ] [ 2.940741e-10 7.828999999999999e-13 5.912968e-11 ] [ 2.574768e-10 9.414562e-11 2.330693e-10 ] [ 2.158325e-10 2.742494e-10 1.504322e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 97.3755319 -205.2069185 -6.1306817 ] [ 45.4249636 183.6061912 2.0240221 ] [ -74.670592 -14.301577 83.2833211 ] [ -55.3704664 -39.5047035 -110.4790101 ] [ 21.198856 0.3811189 130.7028097 ] [ -33.958293 75.025889 -99.4004612 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.560128019335016e-07 -3.287777299558423e-07 -9.822434970231398e-09 ] [ 7.277881528022052e-08 2.941695493983764e-07 3.242840915319611e-09 ] [ -1.196354777493473e-07 -2.291365249875182e-08 1.334345910683391e-07 ] [ -8.871326747976208e-08 -6.329351288079801e-08 -1.7700688852967e-07 ] [ 3.39643117507307e-08 6.106197963557824e-10 2.094089876994885e-07 ] [ -5.440718357512575e-08 1.202047263008776e-07 -1.592570963434636e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 80.916092 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.296418719169943e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.1222062 0.0690281 -0.0366349 ] [ 0.2065206 2.9064483 -0.2890002 ] [ 0.1627764 1.4203056 2.4766254 ] [ 2.77848 -0.568745 0.5357879 ] [ 2.9940389 1.1569286 2.7188561 ] [ 2.1898005 3.6577521 1.6139545 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.222062e-11 6.90281e-12 -3.66349e-12 ] [ 2.065206e-11 2.9064483e-10 -2.890002e-11 ] [ 1.627764e-11 1.4203056e-10 2.4766254e-10 ] [ 2.77848e-10 -5.68745e-11 5.357879e-11 ] [ 2.9940389e-10 1.1569286e-10 2.7188561e-10 ] [ 2.1898005e-10 3.6577521e-10 1.6139545e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.3e-06 -1e-07 -9.6e-06 ] [ 2.9e-05 -1.94e-05 5.69e-05 ] [ 1.28e-05 2.77e-05 -2.58e-05 ] [ -1.7e-05 8.9e-06 -1.72e-05 ] [ 5.9e-06 -1e-07 2.83e-05 ] [ -3.6e-05 -1.7e-05 -3.26e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.4915361602e-15 -1.602176634e-16 -1.53808956864e-14 ] [ 4.6463122386e-14 -3.10822266996e-14 9.116385047459999e-14 ] [ 2.05078609152e-14 4.438029276179999e-14 -4.133615715719999e-14 ] [ -2.723700277799999e-14 1.42593720426e-14 -2.75574381048e-14 ] [ 9.452842140600001e-15 -1.602176634e-16 4.53415987422e-14 ] [ -5.7678358824e-14 -2.723700277799999e-14 -5.22309582684e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.539142 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.489645022480803e-18 } }