{ "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" [ [ 2.61188 5.080623 2.93239 ] [ 4.855786 1.762639 3.084137 ] [ 3.780411 3.32193 1.747479 ] [ 4.346291 4.090656 3.759617 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.61188e-10 5.080623e-10 2.93239e-10 ] [ 4.855786000000001e-10 1.762639e-10 3.084137e-10 ] [ 3.780411e-10 3.32193e-10 1.747479e-10 ] [ 4.346291e-10 4.090656e-10 3.759617e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.3165743 0.9739573 -1.322229 ] [ -0.0751882 0.3487123 0.4789602 ] [ -1.0858506 -0.4029193 -2.8534068 ] [ 3.4776131 -0.9197503 3.6966756 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.711561214384906e-09 1.560451628573728e-09 -2.118444408597186e-09 ] [ -1.204647771925188e-10 5.58698699048398e-10 7.673788410559668e-10 ] [ -1.73972445933488e-09 -6.455478878476362e-10 -4.571661702256711e-09 ] [ 5.571750450912305e-09 -1.47360243977449e-09 5.922727269797929e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.8658476 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.580683049932498e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5777773 5.0032557 2.879453 ] [ 4.7873881 1.8406337 3.1181879 ] [ 3.7318289 3.3535798 1.637352 ] [ 4.4973736 4.0583788 3.8886301 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5777773e-10 5.003255700000001e-10 2.879453e-10 ] [ 4.7873881e-10 1.8406337e-10 3.1181879e-10 ] [ 3.7318289e-10 3.3535798e-10 1.637352e-10 ] [ 4.497373600000001e-10 4.0583788e-10 3.8886301e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.07e-05 1.57e-05 1.6e-06 ] [ 1.7e-06 -1.23e-05 -6e-07 ] [ 1.45e-05 -1e-07 1.27e-05 ] [ 4.5e-06 -3.3e-06 -1.37e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.316505632379999e-14 2.515417315379999e-14 2.5634826144e-15 ] [ 2.7237002778e-15 -1.97067725982e-14 -9.613059803999998e-16 ] [ 2.3231561193e-14 -1.602176634e-16 2.03476432518e-14 ] [ 7.209794853e-15 -5.2871828922e-15 -2.19498198858e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.547084 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.689829154163525e-18 } }