{ "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" [ [ 1.111705 1.964485 2.063826 ] [ 1.996516 4.229048 2.317605 ] [ 3.494235 2.652341 1.536538 ] [ 4.5932 4.863032 2.072185 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.111705e-10 1.964485e-10 2.063826e-10 ] [ 1.996516e-10 4.229048e-10 2.317605e-10 ] [ 3.494235e-10 2.652341e-10 1.536538e-10 ] [ 4.593200000000001e-10 4.863032e-10 2.072185e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3879429 0.253449 -0.0290071 ] [ -0.3069005 1.2412542 0.4635437 ] [ 1.1489164 -0.5784778 -0.3719066 ] [ -1.2299587 -0.9162255 -0.0626299 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.215530445853523e-10 4.060700623651392e-10 -4.647449745720768e-11 ] [ -4.917088060118304e-10 1.988708459709807e-09 7.42678878859129e-10 ] [ 1.840766995333701e-09 -9.268236068118183e-10 -5.958600596412172e-10 ] [ -1.970611073689561e-09 -1.467955075480791e-09 -1.003441615430419e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -8.01139 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.283566175811091e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5432615 2.3477929 1.9865247 ] [ 1.7809024 4.6056865 2.5604151 ] [ 3.8169248 2.2487675 1.4346582 ] [ 4.0545672 4.5066591 2.008556 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5432615e-10 2.3477929e-10 1.9865247e-10 ] [ 1.7809024e-10 4.6056865e-10 2.5604151e-10 ] [ 3.8169248e-10 2.2487675e-10 1.4346582e-10 ] [ 4.0545672e-10 4.5066591e-10 2.008556e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.8e-06 5.3e-06 -1.8e-06 ] [ 7e-07 -2e-06 1.2e-06 ] [ -1.5e-06 1.3e-06 2.6e-06 ] [ -4.9e-06 -4.5e-06 -2.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.292624400640001e-15 8.491536090240001e-15 -2.88391791744e-15 ] [ 1.12152363456e-15 -3.2043532416e-15 1.92261194496e-15 ] [ -2.4032649312e-15 2.08282960704e-15 4.16565921408e-15 ] [ -7.850665441919999e-15 -7.2097947936e-15 -3.36457090368e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.9297943 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.43071076560131e-18 } }