{ "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" [ [ -1.5492697 0.4144692 -1.4356192 ] [ -0.3197864 1.304477 0.3537236 ] [ -0.7550442 0.2732033 -0.6126491 ] [ 2.6241002 -1.9921495 1.6945447 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.48220369265383e-09 6.640528622816793e-10 -2.3001155186116e-09 ] [ -5.123542937297972e-10 2.090002551771322e-09 5.667276821452109e-10 ] [ -1.209714164910639e-09 4.377199399854086e-10 -9.815720647741612e-10 ] [ 4.204271991076604e-09 -3.19177535403841e-09 2.71495990124055e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.715499 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.037247521960578e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.615807 4.1019276 3.1507937 ] [ 3.93776 2.2079649 3.2901998 ] [ 4.1621526 3.6456229 1.4910662 ] [ 4.8786485 4.3003326 3.5915633 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.615807e-10 4.1019276e-10 3.1507937e-10 ] [ 3.93776e-10 2.2079649e-10 3.2901998e-10 ] [ 4.1621526e-10 3.6456229e-10 1.4910662e-10 ] [ 4.8786485e-10 4.3003326e-10 3.5915633e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.6e-06 7.7e-06 -3.5e-06 ] [ 7.7e-06 -2.5e-06 -2.4e-06 ] [ 1.8e-06 3.4e-06 2.36e-05 ] [ -1.11e-05 -8.6e-06 -1.77e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.56348259328e-15 1.233675998016e-14 -5.6076181728e-15 ] [ 1.233675998016e-14 -4.005441552e-15 -3.84522388992e-15 ] [ 2.88391791744e-15 5.44740051072e-15 3.781136825088e-14 ] [ -1.778416049088e-14 -1.377871893888e-14 -2.835852618816e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.70586 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.516356170155789e-18 } }