{ "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" [ [ 2.420109 0.1444118 2.696301 ] [ 1.741529 2.490211 2.002098 ] [ 2.88298 4.123868 0.919121 ] [ 3.624829 1.629307 1.356835 ] [ 3.547112 2.169997 3.636924 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.420109e-10 1.444118e-11 2.696301e-10 ] [ 1.741529e-10 2.490211e-10 2.002098e-10 ] [ 2.88298e-10 4.123868e-10 9.19121e-11 ] [ 3.624829e-10 1.629307e-10 1.356835e-10 ] [ 3.547112e-10 2.169997e-10 3.636924e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.8853095 -15.3902012 2.2569204 ] [ -12.8129339 7.3735666 -3.4814227 ] [ 1.4197126 -0.1056965 -0.8296437 ] [ 8.0555143 1.4117415 -12.5721696 ] [ 8.2230165 6.7105896 14.6263157 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.827128730758222e-09 -2.465782075519876e-08 3.615985129677933e-09 ] [ -2.052858330756649e-08 1.181375611576282e-08 -5.577854103017191e-09 ] [ 2.274630354715388e-09 -1.69344462595581e-10 -1.329235750685306e-09 ] [ 1.290635678631287e-08 2.261859244548111e-09 -2.014283637180513e-08 ] [ 1.317472489729646e-08 1.07515498574834e-08 2.343394125604735e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -12.68516 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.032386695055144e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3099203 0.2641695 2.3719768 ] [ 1.6707743 2.7110103 2.4041988 ] [ 2.7099818 3.7236711 0.4793975 ] [ 3.9827701 1.9121439 1.4326544 ] [ 3.5431124 1.9468001 3.9230514 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3099203e-10 2.641695e-11 2.3719768e-10 ] [ 1.6707743e-10 2.7110103e-10 2.4041988e-10 ] [ 2.7099818e-10 3.7236711e-10 4.793975e-11 ] [ 3.9827701e-10 1.9121439e-10 1.4326544e-10 ] [ 3.5431124e-10 1.9468001e-10 3.9230514e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.1e-06 6.03e-05 -3.65e-05 ] [ 3.75e-05 -6.36e-05 5.68e-05 ] [ 2.76e-05 -4.37e-05 2.99e-05 ] [ -3.37e-05 -1.1e-06 4.51e-05 ] [ -3.03e-05 4.81e-05 -9.52e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.7623942974e-15 9.661125103019999e-14 -5.847944714099999e-14 ] [ 6.008162377499999e-14 -1.018984339224e-13 9.100363281119999e-14 ] [ 4.42200750984e-14 -7.001511890579999e-14 4.790508135659999e-14 ] [ -5.399335256579999e-14 -1.7623942974e-15 7.225816619339999e-14 ] [ -4.854595201019999e-14 7.706469609539999e-14 -1.525272155568e-13 ] ] } "relaxed-potential-energy" { "source-value" -16.808942 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.693089411466122e-18 } }