{ "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" [ [ 2.91343 2.805447 1.311156 ] [ 2.653002 2.505168 3.277079 ] [ 1.829519 4.618852 2.376516 ] [ 4.982305 1.900488 2.423676 ] [ 4.143762 3.996307 2.985709 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.91343e-10 2.805447e-10 1.311156e-10 ] [ 2.653002e-10 2.505168e-10 3.277079e-10 ] [ 1.829519e-10 4.618852000000001e-10 2.376516e-10 ] [ 4.982305e-10 1.900488e-10 2.423676e-10 ] [ 4.143762e-10 3.996307e-10 2.985709e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.4607845 -7.9885024 -19.7215989 ] [ -8.8227147 -12.7313937 13.4165686 ] [ -13.6919616 16.0393494 -1.9383833 ] [ 12.638299 -8.3973462 -1.1180293 ] [ 15.3371618 13.0778928 9.3614428 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.749141257127019e-09 -1.279899178048469e-08 -3.1597484682375e-08 ] [ -1.413554722432849e-08 -2.039794133634041e-08 2.149571254227939e-08 ] [ -2.193694076841137e-08 2.569787062152251e-08 -3.105632405409153e-09 ] [ 2.024878718448002e-08 -1.345403175840372e-08 -1.791280405829389e-09 ] [ 2.457284206538685e-08 2.095309409348865e-08 1.499868479111649e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -10.42077 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.669591406473401e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.0684546 2.8976927 1.0471509 ] [ 2.5954428 2.3798627 3.4975961 ] [ 1.7576727 4.5551415 2.4699735 ] [ 4.8511316 1.7753597 2.4796812 ] [ 4.2493163 4.2182054 2.8797344 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0684546e-10 2.8976927e-10 1.0471509e-10 ] [ 2.5954428e-10 2.3798627e-10 3.4975961e-10 ] [ 1.7576727e-10 4.5551415e-10 2.4699735e-10 ] [ 4.851131600000001e-10 1.7753597e-10 2.4796812e-10 ] [ 4.2493163e-10 4.218205400000001e-10 2.8797344e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.9e-06 -2.47e-05 1e-07 ] [ -8.1e-06 -2.66e-05 -3e-06 ] [ -1.65e-05 3.13e-05 -3.5e-06 ] [ 7.5e-06 8.4e-06 -3.4e-06 ] [ 2.4e-05 1.15e-05 9.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.105501868352e-14 -3.957376253376001e-14 1.6021766208e-16 ] [ -1.297763062848e-14 -4.261789811328e-14 -4.8065298624e-15 ] [ -2.64359142432e-14 5.014812823104e-14 -5.6076181728e-15 ] [ 1.2016324656e-14 1.345828361472e-14 -5.44740051072e-15 ] [ 3.84522388992e-14 1.84250311392e-14 1.570133088384e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.756113 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.844842912488295e-18 } }