{ "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" [ [ 1.724599 2.153048 2.374712 ] [ 0.8645185 3.613019 0.4039649 ] [ 2.279761 4.306527 2.243044 ] [ 4.11856 1.980977 2.568835 ] [ 3.209467 2.952847 0.6643367 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.724599e-10 2.153048e-10 2.374712e-10 ] [ 8.645185e-11 3.613019e-10 4.039649e-11 ] [ 2.279761e-10 4.306527e-10 2.243044e-10 ] [ 4.118560000000001e-10 1.980977e-10 2.568835e-10 ] [ 3.209467e-10 2.952847e-10 6.643367000000001e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -20.7027325 -30.7626219 17.191227 ] [ -11.1114572 3.1143392 -9.0388284 ] [ 1.0561084 35.5263115 14.292196 ] [ 11.9887838 -6.9803613 10.562427 ] [ 18.7692974 -0.8976676 -33.0070216 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.31694342714524e-08 -4.928715400875668e-08 2.754338220918992e-08 ] [ -1.780251709553106e-08 4.989721496590252e-09 -1.44817996612156e-08 ] [ 1.692072201451125e-09 5.691942617750548e-08 2.289862247974827e-08 ] [ 1.920814927443773e-08 -1.118377177173786e-08 1.692287373773072e-08 ] [ 3.007172973087695e-08 -1.438222053818858e-09 -5.288307876545329e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -4.6824677 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.502140338399722e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.7493476 2.3015202 2.708795 ] [ 0.8732097 3.2316073 0.3472824 ] [ 1.9518014 4.9242764 2.1707752 ] [ 4.0945016 1.2657984 2.2826549 ] [ 3.5280453 3.2832157 0.7453851 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7493476e-10 2.3015202e-10 2.708795e-10 ] [ 8.732097e-11 3.2316073e-10 3.472824e-11 ] [ 1.9518014e-10 4.924276400000001e-10 2.1707752e-10 ] [ 4.0945016e-10 1.2657984e-10 2.2826549e-10 ] [ 3.5280453e-10 3.2832157e-10 7.453851e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.07e-05 -7.86e-05 -5.35e-05 ] [ -6.93e-05 1.22e-05 1.93e-05 ] [ -1.43e-05 8.05e-05 2.4e-06 ] [ -3.88e-05 4.96e-05 1.17e-05 ] [ 7.17e-05 -6.37e-05 2.03e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.123035534379999e-14 -1.259310834324e-13 -8.571644991899998e-14 ] [ -1.110308407362e-13 1.95465549348e-14 3.09220090362e-14 ] [ -2.29111258662e-14 1.28975219037e-13 3.845223921599999e-15 ] [ -6.21644533992e-14 7.94679610464e-14 1.87454666178e-14 ] [ 1.148760646578e-13 -1.020586515858e-13 3.252418567019999e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.624493 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.663537423669656e-18 } }