{ "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" [ [ 1.107976 2.819188 1.252407 ] [ 2.630591 3.411672 3.024039 ] [ 3.968262 4.362454 1.692316 ] [ 3.394725 3.292047 0.1208017 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.107976e-10 2.819188e-10 1.252407e-10 ] [ 2.630591e-10 3.411672e-10 3.024039e-10 ] [ 3.968262e-10 4.362454e-10 1.692316e-10 ] [ 3.394725e-10 3.292047e-10 1.208017e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.9967125 0.5072087 -0.1302423 ] [ -2.1595291 -2.1885756 -1.6177848 ] [ 5.035717 6.4080673 4.1314345 ] [ -4.8729005 -4.7267004 -2.3834074 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.19908608595912e-09 8.126379210063609e-10 -2.086711680992198e-10 ] [ -3.459947035957265e-09 -3.506484659173333e-09 -2.591976984045604e-09 ] [ 8.068108046365114e-09 1.026685561257298e-08 6.619287766266538e-09 ] [ -7.807247256584631e-09 -7.57300887440601e-09 -3.818639614121714e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.1217153 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.461459899525366e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1054255 3.160861 1.1664349 ] [ 2.7982923 3.0340162 2.7386505 ] [ 3.8955622 4.7852147 1.6979554 ] [ 3.302274 2.905269 0.4865229 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1054255e-10 3.160861e-10 1.1664349e-10 ] [ 2.7982923e-10 3.0340162e-10 2.7386505e-10 ] [ 3.8955622e-10 4.785214700000001e-10 1.6979554e-10 ] [ 3.302274e-10 2.905269e-10 4.865229e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.4e-06 -8e-07 -1.6e-06 ] [ -4.9e-06 -1.33e-05 -0.0 ] [ 6.3e-06 4e-06 -1.35e-05 ] [ 0.0 1.01e-05 1.51e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.24304726912e-15 -1.28174129664e-15 -2.56348259328e-15 ] [ -7.850665441919999e-15 -2.130894905664e-14 0.0 ] [ 1.009371271104e-14 6.4087064832e-15 -2.16293843808e-14 ] [ 0.0 1.618198387008e-14 2.419286697408e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.111763 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.100736013607047e-18 } }