{ "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" [ [ 2.03068 2.305251 2.057253 ] [ 2.579116 2.417689 4.578894 ] [ 0.1076423 2.252956 3.524492 ] [ 1.371288 4.166573 3.55215 ] [ 3.675708 3.460848 3.322007 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.03068e-10 2.305251e-10 2.057253e-10 ] [ 2.579116e-10 2.417689e-10 4.578894e-10 ] [ 1.076423e-11 2.252956e-10 3.524492e-10 ] [ 1.371288e-10 4.166573e-10 3.55215e-10 ] [ 3.675708000000001e-10 3.460848e-10 3.322007e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3121388 -0.067948 0.7946892 ] [ -5.9231251 -5.1839342 4.0295458 ] [ 0.9255782 -1.0329597 0.6344166 ] [ 0.2378194 1.6892757 -0.5128934 ] [ 5.0718663 4.5955662 -4.9457582 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.00101487804567e-10 -1.088646970301184e-10 1.273232457042255e-09 ] [ -9.489892557293662e-09 -8.305578179005552e-09 6.456044073202833e-09 ] [ 1.482939752762147e-09 -1.654983881568582e-09 1.016447444367425e-09 ] [ 3.810286826526835e-10 2.706518032625555e-09 -8.217458144426228e-10 ] [ 8.126025609683399e-09 7.362908724978697e-09 -7.92397816016989e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.126616 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.583768712781921e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0592707 2.2928887 2.1428766 ] [ 2.3520232 2.229824 4.5760417 ] [ 0.1365721 2.2099196 3.6070727 ] [ 1.4473654 4.2392793 3.5019585 ] [ 3.7692029 3.6314054 3.2068466 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0592707e-10 2.2928887e-10 2.1428766e-10 ] [ 2.3520232e-10 2.229824e-10 4.5760417e-10 ] [ 1.365721e-11 2.2099196e-10 3.6070727e-10 ] [ 1.4473654e-10 4.2392793e-10 3.5019585e-10 ] [ 3.7692029e-10 3.6314054e-10 3.2068466e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.9e-06 -1.8e-06 6e-07 ] [ 6.3e-06 -2.4e-06 2.8e-06 ] [ -8e-06 5.5e-06 -2.3e-06 ] [ 7e-06 -4.8e-06 1.4e-06 ] [ -1.21e-05 3.5e-06 -2.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.105501868352e-14 -2.88391791744e-15 9.6130597248e-16 ] [ 1.009371271104e-14 -3.84522388992e-15 4.48609453824e-15 ] [ -1.28174129664e-14 8.8119714144e-15 -3.68500622784e-15 ] [ 1.12152363456e-14 -7.69044777984e-15 2.24304726912e-15 ] [ -1.938633711168e-14 5.6076181728e-15 -4.005441552e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.096417 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.899365623764767e-18 } }