{ "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" [ [ 0.3126518 0.5217928 0.1846885 ] [ 0.8333114 2.588069 2.680495 ] [ 2.642381 0.0430457 2.992394 ] [ 2.45603 2.243401 1.184533 ] [ 2.245972 1.834771 2.762862 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.126518e-11 5.217928e-11 1.846885e-11 ] [ 8.333114000000001e-11 2.588069e-10 2.680495e-10 ] [ 2.642381e-10 4.30457e-12 2.992394e-10 ] [ 2.45603e-10 2.243401e-10 1.184533e-10 ] [ 2.245972e-10 1.834771e-10 2.762862e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 5.5e-05 4.42e-05 2.57e-05 ] [ -23.9470958 6.1475208 12.9763034 ] [ 0.794516 -25.0312511 19.2938734 ] [ 13.3534164 21.9022346 -39.2201762 ] [ 9.7991084 -3.0185485 6.9499738 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.811971486999999e-14 7.08162072228e-14 4.11759394938e-14 ] [ -3.836747734291953e-08 9.849414182788986e-09 2.079033010317475e-08 ] [ 1.272954970539144e-09 -4.010448563220679e-08 3.091219314083413e-08 ] [ 2.139453174015239e-08 3.509124850850634e-08 -6.28376498890029e-08 ] [ 1.569990251251312e-08 -4.836247875295749e-09 1.113508562927219e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 4.8418454 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.757491565320384e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.3126519 0.5217929 0.1846886 ] [ 0.5146489 2.8541641 2.4568724 ] [ 2.7409986 -0.5624648 3.3360006 ] [ 2.2457977 2.6939202 0.7760205 ] [ 2.6762491 1.7236672 3.0513904 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.126519e-11 5.217929e-11 1.846886e-11 ] [ 5.146489e-11 2.8541641e-10 2.4568724e-10 ] [ 2.7409986e-10 -5.624648e-11 3.3360006e-10 ] [ 2.2457977e-10 2.6939202e-10 7.760205e-11 ] [ 2.6762491e-10 1.7236672e-10 3.0513904e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 0.0 0.0 ] [ -9.2e-06 -7e-07 1.5e-06 ] [ -3.4e-06 1.7e-06 2.6e-06 ] [ 1.4e-06 6.6e-06 -1e-05 ] [ 1.11e-05 -7.5e-06 5.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ -1.47400250328e-14 -1.1215236438e-15 2.403264951e-15 ] [ -5.4474005556e-15 2.7237002778e-15 4.165659248399999e-15 ] [ 2.2430472876e-15 1.05743657844e-14 -1.602176634e-14 ] [ 1.77841606374e-14 -1.2016324755e-14 9.2926244772e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.326579 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.654500358295509e-18 } }