{ "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" [ [ 1.152391 0.2084818 1.476287 ] [ 0.2004725 1.985654 1.37487 ] [ 0.8976264 2.29727 2.845471 ] [ 1.752289 1.001076 2.997864 ] [ 1.785348 1.533822 0.3428561 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.152391e-10 2.084818e-11 1.476287e-10 ] [ 2.004725e-11 1.985654e-10 1.37487e-10 ] [ 8.976264000000001e-11 2.29727e-10 2.845471e-10 ] [ 1.752289e-10 1.001076e-10 2.997864e-10 ] [ 1.785348e-10 1.533822e-10 3.428561e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.2215114 -19.3534426 -5.1353048 ] [ -15.5663356 9.3872152 -9.1869725 ] [ -1.5593654 13.9345245 6.9201215 ] [ 11.6792762 -7.8078678 11.3439911 ] [ 5.2249135 3.8395706 -3.9418352 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.549003892446275e-10 -3.100763352118021e-08 -8.227665359028042e-09 ] [ -2.494001917532237e-08 1.503997685176963e-08 -1.471915267670056e-08 ] [ -2.498378807748063e-09 2.232556955980053e-08 1.108725697174103e-08 ] [ 1.871226342967231e-08 -1.250958335052098e-08 1.817507747672396e-08 ] [ 8.371234324371159e-09 6.15167029991336e-09 -6.315516252518716e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 0.52243092 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.370266129031233e-20 } "relaxed-configuration-positions" { "source-value" [ [ 0.7772906 -0.313782 1.3446259 ] [ -0.4651697 1.8649125 1.1223657 ] [ 1.0656792 2.9116065 2.825537 ] [ 2.3081745 0.7329219 3.0477549 ] [ 2.1021523 1.830645 0.6970646 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.772906000000001e-11 -3.13782e-11 1.3446259e-10 ] [ -4.651697000000001e-11 1.8649125e-10 1.1223657e-10 ] [ 1.0656792e-10 2.9116065e-10 2.825537e-10 ] [ 2.3081745e-10 7.329219000000001e-11 3.0477549e-10 ] [ 2.1021523e-10 1.830645e-10 6.970646000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.26e-05 -5.25e-05 4.3e-06 ] [ 7.45e-05 3.36e-05 3.36e-05 ] [ -2.71e-05 5.3e-06 -7.4e-06 ] [ -3.2e-05 1.7e-05 -4.34e-05 ] [ -2.8e-05 -3.4e-06 1.29e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.01874255884e-14 -8.4114273285e-14 6.8893595262e-15 ] [ 1.19362159233e-13 5.383313490239999e-14 5.383313490239999e-14 ] [ -4.34189867814e-14 8.4915361602e-15 -1.18561070916e-14 ] [ -5.126965228799999e-14 2.723700277799999e-14 -6.953446591559999e-14 ] [ -4.486094575199999e-14 -5.4474005556e-15 2.06680785786e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.126158 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.423477690979217e-18 } }