{ "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" [ [ 0.7955699 1.924478 0.0578634 ] [ 0.2789322 2.342777 2.34838 ] [ 2.533834 0.6960937 0.5593318 ] [ 1.694509 0.4311754 2.932881 ] [ 2.816233 2.726519 1.407602 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.955699e-11 1.924478e-10 5.786340000000001e-12 ] [ 2.789322e-11 2.342777e-10 2.34838e-10 ] [ 2.533834e-10 6.960937e-11 5.593318000000001e-11 ] [ 1.694509e-10 4.311754e-11 2.932881e-10 ] [ 2.816233e-10 2.726519e-10 1.407602e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -73.2669643 -9.7458491 -89.7899799 ] [ 91.3466675 40.5693093 5.5735212 ] [ 25.1503922 -99.4725044 -24.6484116 ] [ 6.6290475 -11.2150133 0.5788287 ] [ -49.8591429 79.8640574 108.2860416 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.173866172784482e-07 -1.561457157786472e-08 -1.438594065778819e-07 ] [ 1.463534950564912e-07 6.499919888246402e-08 8.92976536217316e-09 ] [ 4.029537038679068e-08 -1.593725209621051e-07 -3.949110880537552e-08 ] [ 1.062090492267269e-08 -1.796843211122106e-08 9.27385810588057e-10 ] [ -7.988315308750631e-08 1.279563256085092e-07 1.734933642104962e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 17.654285 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.828528268394013e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4625556 1.8554126 -0.2219485 ] [ 0.3090399 2.6386915 2.6204228 ] [ 2.9195331 0.3916346 0.5107068 ] [ 1.4847297 0.0325511 2.9843844 ] [ 2.9432198 3.2027532 1.4124927 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.625556e-11 1.8554126e-10 -2.219485e-11 ] [ 3.090399e-11 2.6386915e-10 2.6204228e-10 ] [ 2.9195331e-10 3.916346e-11 5.107068e-11 ] [ 1.4847297e-10 3.25511e-12 2.9843844e-10 ] [ 2.9432198e-10 3.2027532e-10 1.4124927e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.6e-06 -2.9e-06 -8e-07 ] [ -6e-07 -5e-07 -5e-07 ] [ -1.3e-06 1.6e-06 1e-07 ] [ -5e-07 -6e-07 -3e-07 ] [ 5.1e-06 2.4e-06 1.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.16565921408e-15 -4.646312200320001e-15 -1.28174129664e-15 ] [ -9.6130597248e-16 -8.010883104e-16 -8.010883104e-16 ] [ -2.08282960704e-15 2.56348259328e-15 1.6021766208e-16 ] [ -8.010883104e-16 -9.6130597248e-16 -4.8065298624e-16 ] [ 8.17110076608e-15 3.84522388992e-15 2.4032649312e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.133456 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.943993953270549e-18 } }