{ "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" [ [ 1.248143 2.607252 2.065498 ] [ 1.369551 0.7649094 4.123488 ] [ 1.757865 4.314259 0.9683886 ] [ 3.278515 2.86873 1.593912 ] [ 3.883205 5.101974 1.552288 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.248143e-10 2.607252e-10 2.065498e-10 ] [ 1.369551e-10 7.649094e-11 4.123488e-10 ] [ 1.757865e-10 4.314259e-10 9.683886000000001e-11 ] [ 3.278515e-10 2.86873e-10 1.593912e-10 ] [ 3.883205e-10 5.101974000000001e-10 1.552288e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.5229816 -6.6376088 5.3212625 ] [ 0.0096251 1.374205 -1.4233594 ] [ -4.0906259 7.7664634 -4.8057394 ] [ 8.4751064 -4.9557436 0.5811846 ] [ 2.128876 2.452684 0.3266518 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.045096861742858e-08 -1.063462163737634e-08 8.525602370639759e-09 ] [ 1.542111019286208e-11 2.201719123186464e-09 -2.280473153675916e-09 ] [ -6.553905181418959e-09 1.244324608577888e-08 -7.69964331233742e-09 ] [ 1.357861733287245e-08 -7.939976534599227e-09 9.311603784889998e-10 ] [ 3.410835355782221e-09 3.929632963010227e-09 5.233538771022374e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -7.2989999 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.169428699500154e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.9957188 2.4272311 1.6283572 ] [ 1.932408 1.6035543 3.6582525 ] [ 1.3554138 4.6834851 1.1991205 ] [ 3.6348816 2.3368777 2.1615341 ] [ 3.6188568 4.6059762 1.6563103 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.957188000000001e-11 2.4272311e-10 1.6283572e-10 ] [ 1.932408e-10 1.6035543e-10 3.6582525e-10 ] [ 1.3554138e-10 4.6834851e-10 1.1991205e-10 ] [ 3.6348816e-10 2.3368777e-10 2.1615341e-10 ] [ 3.6188568e-10 4.6059762e-10 1.6563103e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8e-07 -1.02e-05 -4e-06 ] [ 2.37e-05 1.86e-05 4e-07 ] [ 1.71e-05 7.3e-06 -8.3e-06 ] [ -2.21e-05 -1.91e-05 -7.8e-06 ] [ -1.95e-05 3.4e-06 1.96e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.28174129664e-15 -1.634220153216e-14 -6.4087064832e-15 ] [ 3.797158591296e-14 2.980048514688e-14 6.408706483200001e-16 ] [ 2.739722021568e-14 1.169588933184e-14 -1.329806595264e-14 ] [ -3.540810331968e-14 -3.060157345728e-14 -1.249697764224e-14 ] [ -3.12424441056e-14 5.44740051072e-15 3.140266176767999e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.95897 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.916038214284858e-18 } }