{ "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" [ [ 1.889016 4.339495 1.275975 ] [ 2.554838 3.101562 2.999193 ] [ 4.055705 3.657127 1.332404 ] [ 4.476672 4.505138 3.486766 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.889016e-10 4.339495e-10 1.275975e-10 ] [ 2.554838e-10 3.101562e-10 2.999193e-10 ] [ 4.055705e-10 3.657127e-10 1.332404e-10 ] [ 4.476672e-10 4.505138e-10 3.486766e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.5470843 2.6496838 -3.1292011 ] [ -4.7703864 -4.4114814 6.8771021 ] [ 6.8457713 -0.0518767 -6.5317412 ] [ 2.4716993 1.8136743 2.7838402 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.285232158266734e-09 4.245261436872503e-09 -5.013532844201643e-09 ] [ -7.643001562262277e-09 -7.067972362174053e-09 1.101833220347458e-08 ] [ 1.096813472820362e-08 -8.311563590425535e-11 -1.046500304375614e-08 ] [ 3.960098832107726e-09 2.905826561205805e-09 4.460203684483196e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.4523498 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.354215724038356e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0200599 3.8411381 1.206647 ] [ 2.21627 3.5225654 3.4738587 ] [ 4.2699472 4.28936 1.0749661 ] [ 4.4699539 3.9502586 3.3388662 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0200599e-10 3.8411381e-10 1.206647e-10 ] [ 2.21627e-10 3.5225654e-10 3.4738587e-10 ] [ 4.2699472e-10 4.28936e-10 1.0749661e-10 ] [ 4.4699539e-10 3.9502586e-10 3.3388662e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.2e-06 1.7e-06 -9e-07 ] [ 2.3e-06 -1e-06 -2.9e-06 ] [ -1.4e-06 -2.6e-06 2.6e-06 ] [ 1.3e-06 2e-06 1.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.52478856576e-15 2.72370025536e-15 -1.44195895872e-15 ] [ 3.68500622784e-15 -1.6021766208e-15 -4.646312200320001e-15 ] [ -2.24304726912e-15 -4.16565921408e-15 4.16565921408e-15 ] [ 2.08282960704e-15 3.2043532416e-15 1.92261194496e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.755714 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.883473013161125e-18 } }