{ "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" [ [ 2.360944 2.643853 2.165766 ] [ 2.694587 4.80447 3.102481 ] [ 4.665525 1.923814 2.374826 ] [ 4.545146 3.928705 1.722535 ] [ 3.943017 3.203445 4.218269 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.360944e-10 2.643853e-10 2.165766e-10 ] [ 2.694587e-10 4.80447e-10 3.102481e-10 ] [ 4.665525e-10 1.923814e-10 2.374826e-10 ] [ 4.545146e-10 3.928705e-10 1.722535e-10 ] [ 3.943017e-10 3.203445e-10 4.218269e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.9175816 -2.1724967 -1.4492569 ] [ -1.739852 3.5016836 0.2617825 ] [ 2.477676 -6.526021 0.2876102 ] [ 2.244642 5.8356258 -3.9213253 ] [ 0.9351156 -0.6387916 4.8211895 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.276657649596258e-09 -3.480723421505151e-09 -2.321965522713083e-09 ] [ -2.787550198052122e-09 5.610315597358778e-09 4.19421801234576e-10 ] [ 3.969674561117262e-09 -1.045583827304984e-08 4.608023383436122e-10 ] [ 3.596312934465753e-09 9.349703224497295e-09 -6.282655718211546e-09 ] [ 1.498220352065365e-09 -1.023456967083425e-09 7.724397101346443e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.8094156 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.251206309643081e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0535701 2.4301223 2.0450542 ] [ 2.7562904 4.6836972 3.018111 ] [ 4.5273968 1.9180177 2.4154399 ] [ 4.7817152 4.2930559 1.5133471 ] [ 4.0902465 3.1793939 4.5919248 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0535701e-10 2.4301223e-10 2.0450542e-10 ] [ 2.7562904e-10 4.6836972e-10 3.018111000000001e-10 ] [ 4.5273968e-10 1.9180177e-10 2.4154399e-10 ] [ 4.7817152e-10 4.2930559e-10 1.5133471e-10 ] [ 4.0902465e-10 3.1793939e-10 4.5919248e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.7e-06 -3.6e-06 -3.6e-06 ] [ 8.5e-06 1.2e-06 -4.8e-06 ] [ 2.1e-06 -6e-06 2.9e-06 ] [ -6.5e-06 7e-06 6.2e-06 ] [ 2.7e-06 1.4e-06 -6e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.073458335936e-14 -5.76783583488e-15 -5.76783583488e-15 ] [ 1.36185012768e-14 1.92261194496e-15 -7.69044777984e-15 ] [ 3.36457090368e-15 -9.6130597248e-15 4.646312200320001e-15 ] [ -1.04141480352e-14 1.12152363456e-14 9.93349504896e-15 ] [ 4.32587687616e-15 2.24304726912e-15 -9.6130597248e-16 ] ] } "relaxed-potential-energy" { "source-value" -11.212408 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.796425796047089e-18 } }