{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.8884438 2.916456 2.400624 ] [ 2.811423 1.824332 1.936915 ] [ 1.907829 2.277214 4.357236 ] [ 1.702277 4.831739 3.243262 ] [ 3.61245 3.93555 1.732923 ] [ 3.530316 5.918227 2.544774 ] [ 3.982422 3.894872 3.827608 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.884438000000001e-11 2.916456e-10 2.400624e-10 ] [ 2.811423e-10 1.824332e-10 1.936915e-10 ] [ 1.907829e-10 2.277214e-10 4.357236e-10 ] [ 1.702277e-10 4.831739e-10 3.243262e-10 ] [ 3.61245e-10 3.93555e-10 1.732923e-10 ] [ 3.530316e-10 5.918227e-10 2.544774e-10 ] [ 3.982422e-10 3.894872e-10 3.827608e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7570652 -0.2288856 -0.4482124 ] [ 0.1547042 -0.487373 0.6050691 ] [ 1.091624 0.7377132 -0.5699658 ] [ -0.4257645 0.0665783 0.8221947 ] [ 0.0401754 -1.3871743 -3.2716503 ] [ 0.4750399 1.9716176 0.608594 ] [ -0.5787138 -0.6724763 2.2539707 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.212952163861276e-09 -3.667151571577805e-10 -7.18115428432658e-10 ] [ 2.478634523795673e-10 -7.808576262091585e-10 9.694275659884974e-10 ] [ 1.748974451504179e-09 1.181946841895555e-09 -9.131858794155686e-10 ] [ -6.821499278666016e-10 1.066701957126087e-10 1.31730112608567e-09 ] [ 6.436808661128832e-11 -2.222498232434605e-09 -5.241761622093307e-09 ] [ 7.6109782172717e-10 3.158879623877806e-09 9.750750783591552e-10 ] [ -9.272017204943269e-10 -1.077425805902087e-09 3.611259159508211e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.390918 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.10676754754499e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.184528 3.1635828 1.9710562 ] [ 3.0826151 1.7876368 2.3964353 ] [ 2.0273897 2.7883986 4.2837317 ] [ 1.1730838 4.9056384 3.5982026 ] [ 3.3976919 3.8681281 1.2787599 ] [ 3.3292983 5.5920598 2.9237193 ] [ 4.2405539 3.4929454 3.591437 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.184528e-10 3.1635828e-10 1.9710562e-10 ] [ 3.0826151e-10 1.7876368e-10 2.3964353e-10 ] [ 2.0273897e-10 2.7883986e-10 4.2837317e-10 ] [ 1.1730838e-10 4.905638400000001e-10 3.5982026e-10 ] [ 3.3976919e-10 3.8681281e-10 1.2787599e-10 ] [ 3.3292983e-10 5.592059800000001e-10 2.9237193e-10 ] [ 4.2405539e-10 3.4929454e-10 3.591437e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.13e-05 -6.9e-06 -3.9e-05 ] [ 1.67e-05 -2.11e-05 -1.4e-06 ] [ 1.5e-06 -2.24e-05 4.94e-05 ] [ -2.44e-05 2.64e-05 1.15e-05 ] [ 4.9e-06 1.52e-05 -3.35e-05 ] [ 2.19e-05 8.1e-06 -1.7e-06 ] [ 1.08e-05 8e-07 1.47e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.014812823104e-14 -1.105501868352e-14 -6.248488821120001e-14 ] [ 2.675634956736e-14 -3.380592669888e-14 -2.24304726912e-15 ] [ 2.4032649312e-15 -3.588875630592e-14 7.914752506752001e-14 ] [ -3.909310954752e-14 4.229746278912e-14 1.84250311392e-14 ] [ 7.850665441919999e-15 2.435308463616e-14 -5.36729167968e-14 ] [ 3.508766799552e-14 1.297763062848e-14 -2.72370025536e-15 ] [ 1.730350750464e-14 1.28174129664e-15 2.355199632576e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.43874 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.434864800740979e-18 } }