{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0066411 1.299857 0.8298456 ] [ 0.9999642 1.240181 2.737035 ] [ 2.654666 1.132969 0.0147569 ] [ 2.745471 0.2375767 2.196855 ] [ 1.997397 2.884463 1.181944 ] [ 2.106064 2.994709 2.966195 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.6411e-13 1.299857e-10 8.298456e-11 ] [ 9.999642e-11 1.240181e-10 2.737035e-10 ] [ 2.654666e-10 1.132969e-10 1.47569e-12 ] [ 2.745471000000001e-10 2.375767e-11 2.196855e-10 ] [ 1.997397e-10 2.884463e-10 1.181944e-10 ] [ 2.106064e-10 2.994709e-10 2.966195e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 102.6617776 64.060693 -137.9619113 ] [ -16.1069354 -53.0260013 254.0540498 ] [ -66.0245719 -40.5496163 20.0587196 ] [ 39.5282563 -28.5640109 -24.7611684 ] [ -49.9738347 91.499875 -314.623828 ] [ -10.0846919 -33.4209395 203.2341384 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.644823012756246e-07 1.026365454824474e-07 -2.210393506668405e-07 ] [ -2.580615554322744e-08 -8.495702027731361e-08 4.070394623626324e-07 ] [ -1.05783026368033e-07 -6.496764775352552e-08 3.213761185107783e-08 ] [ 6.333124862662329e-08 -4.57645908373013e-08 -3.967176544101916e-08 ] [ -8.00669102677184e-08 1.465989617389208e-07 -5.040829457212349e-07 ] [ -1.615745772326906e-08 -5.354624835322764e-08 3.256169877756021e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 88.217749 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.413404161518768e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.0450638 1.439186 0.7639478 ] [ 0.755142 0.8622316 3.3547756 ] [ 2.7552594 0.9174913 -0.2594856 ] [ 2.963449 -0.4062092 2.2067808 ] [ 2.0412774 3.589933 0.5313288 ] [ 1.9500117 3.3871231 3.3292839 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.50638e-12 1.439186e-10 7.639478e-11 ] [ 7.55142e-11 8.622316e-11 3.3547756e-10 ] [ 2.7552594e-10 9.174913000000001e-11 -2.594856e-11 ] [ 2.963449e-10 -4.062092e-11 2.2067808e-10 ] [ 2.0412774e-10 3.589933e-10 5.313288e-11 ] [ 1.9500117e-10 3.3871231e-10 3.3292839e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.4e-05 -1.16e-05 -1.31e-05 ] [ 3.55e-05 -2.15e-05 -1.5e-05 ] [ -1.72e-05 5.44e-05 -5.8e-06 ] [ -1.99e-05 -9.9e-06 4.43e-05 ] [ 2.26e-05 -2.31e-05 2.6e-06 ] [ 3e-06 1.17e-05 -1.31e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.8452239216e-14 -1.85852489544e-14 -2.09885139054e-14 ] [ 5.6877270507e-14 -3.4446797631e-14 -2.403264951e-14 ] [ -2.75574381048e-14 8.71584088896e-14 -9.2926244772e-15 ] [ -3.18833150166e-14 -1.58615486766e-14 7.09764248862e-14 ] [ 3.62091919284e-14 -3.70102802454e-14 4.165659248399999e-15 ] [ 4.806529901999999e-15 1.87454666178e-14 -2.09885139054e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.691321 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.514026786279351e-18 } }