{ "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" [ [ 0.1515051 0.6129927 0.4125648 ] [ 0.5354239 0.8367141 2.920626 ] [ 0.0380374 2.448484 2.393252 ] [ 2.476891 0.0370714 1.494005 ] [ 2.980221 0.9767319 2.515602 ] [ 2.390623 2.921281 2.114549 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.515051e-11 6.129927e-11 4.125648000000001e-11 ] [ 5.354239e-11 8.367141000000001e-11 2.920626e-10 ] [ 3.80374e-12 2.448484e-10 2.393252e-10 ] [ 2.476891e-10 3.707139999999999e-12 1.494005e-10 ] [ 2.980221e-10 9.767319e-11 2.515602e-10 ] [ 2.390623e-10 2.921281e-10 2.114549e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.8854069 -7.0078982 -22.0251651 ] [ -17.6600858 -6.1687484 18.8233195 ] [ -18.7976707 12.7319137 6.1043757 ] [ 47.3142487 42.910688 57.1656348 ] [ -9.3393781 -70.2773124 -57.5208978 ] [ 12.3682928 27.8113573 -2.547267 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.2246874305475e-08 -1.12278906569864e-08 -3.528820459248009e-08 ] [ -2.829457659008207e-08 -9.883424466077407e-09 3.015828242874875e-08 ] [ -3.011718852103717e-08 2.039877446818323e-08 9.780288031119636e-09 ] [ 7.58057830978568e-08 6.875050109604311e-08 9.158944358975088e-08 ] [ -1.496333324463152e-08 -1.125966668999379e-07 -9.215863766258617e-08 ] [ 1.981618956336897e-08 4.455870645877541e-08 -4.081171634335354e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 295.24146 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.730289647028584e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.0474207 0.5603739 0.2473698 ] [ 0.4030154 0.7899651 3.0620248 ] [ -0.1031213 2.5445177 2.4388773 ] [ 2.8709791 0.4042198 2.0033828 ] [ 2.8709791 0.4042198 2.0033828 ] [ 2.4834284 3.1299789 2.0955612 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.742070000000001e-12 5.603739e-11 2.473698e-11 ] [ 4.030154e-11 7.899651e-11 3.0620248e-10 ] [ -1.031213e-11 2.5445177e-10 2.4388773e-10 ] [ 2.8709791e-10 4.042198e-11 2.0033828e-10 ] [ 2.8709791e-10 4.042198e-11 2.0033828e-10 ] [ 2.4834284e-10 3.1299789e-10 2.0955612e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -10.2406156 -6.1962358 -17.3896287 ] [ -12.5753006 -12.5050217 18.1230696 ] [ -17.2988832 18.4228986 2.1675707 ] [ 14.795995 1.296975823800375e+110 1.0375806590403e+111 ] [ 14.795995 -1.296975823800375e+110 -1.0375806590403e+111 ] [ 10.5228094 21.5660055 -0.4627528 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.640727489691977e-08 -9.927464135723986e-09 -2.78612565475327e-08 ] [ -2.014785262085221e-08 -2.003525341033667e-08 2.903635841025121e-08 ] [ -2.771586622898989e-08 2.951673742428905e-08 3.472831099471091e-09 ] [ 2.37057972704737e-08 2.077984342635781e+101 1.662387474108625e+102 ] [ 2.37057972704737e-08 -2.077984342635781e+101 -1.662387474108625e+102 ] [ 1.685939920581447e-08 3.455254981614421e-08 -7.414117173697383e-10 ] ] } "relaxed-potential-energy" { "source-value" -7.799634e+94 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.249639124559679e+76 } }