{ "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" [ [ 0.9865114 1.002248 2.003773 ] [ 2.302262 0.4465448 0.4828732 ] [ 2.913212 0.9916658 2.458282 ] [ 2.765138 2.782808 0.4747325 ] [ 1.558206 2.989621 2.793764 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.865114e-11 1.002248e-10 2.003773e-10 ] [ 2.302262e-10 4.465448e-11 4.828732e-11 ] [ 2.913212e-10 9.916658000000001e-11 2.458282e-10 ] [ 2.765138e-10 2.782808e-10 4.747325e-11 ] [ 1.558206e-10 2.989621e-10 2.793764e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.5412295 -0.6140446 1.322815 ] [ 1.284565 -0.8080528 -4.1440692 ] [ 3.6625148 0.5472516 2.792429 ] [ -0.1924026 -0.019342 0.5654167 ] [ 0.7865523 0.8941878 -0.5365916 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.878028428531502e-09 -9.838079103538763e-10 2.11938328410471e-09 ] [ 2.05810002785421e-09 -1.294643315198275e-09 -6.639530841919071e-09 ] [ 5.867995634239182e-09 8.767937264391142e-10 4.473964495903985e-09 ] [ -3.082629500408484e-10 -3.0989300454828e-11 9.058974252133876e-10 ] [ 1.260195716478958e-09 1.432646799567865e-09 -8.597145235206742e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.703516 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.035327650484514e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7223547 0.7949143 2.1754565 ] [ 2.1660166 0.5625522 0.3220394 ] [ 3.1230328 1.1235233 2.5006932 ] [ 2.9788185 2.7497548 0.6809315 ] [ 1.5351067 2.9821429 2.5343042 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.223547000000001e-11 7.949143e-11 2.1754565e-10 ] [ 2.1660166e-10 5.625522e-11 3.220394e-11 ] [ 3.1230328e-10 1.1235233e-10 2.5006932e-10 ] [ 2.9788185e-10 2.7497548e-10 6.809315e-11 ] [ 1.5351067e-10 2.9821429e-10 2.5343042e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.86e-05 1.85e-05 -1.49e-05 ] [ 6.4e-06 -3.4e-06 2.01e-05 ] [ -2.12e-05 -4e-07 -5.2e-06 ] [ -9.7e-06 2.2e-06 -1.28e-05 ] [ 5.9e-06 -1.69e-05 1.29e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.98004853924e-14 2.9640267729e-14 -2.38724318466e-14 ] [ 1.02539304576e-14 -5.4474005556e-15 3.22037503434e-14 ] [ -3.39661446408e-14 -6.408706536e-16 -8.331318496799998e-15 ] [ -1.55411133498e-14 3.5247885948e-15 -2.05078609152e-14 ] [ 9.452842140600001e-15 -2.70767851146e-14 2.06680785786e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.50509 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.323971627206706e-18 } }