{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 9.535140000000001e-12 6.227093e-11 7.960489e-11 ] [ 2.435865e-11 7.233135000000001e-11 3.3503906e-10 ] [ 1.1070408e-10 2.9533208e-10 1.1154648e-10 ] [ -3.921724e-11 3.05184e-10 3.0312312e-10 ] [ 2.4128487e-10 -1.085694e-11 9.609194e-11 ] [ 2.5737279e-10 1.5787858e-10 2.707713e-10 ] ] "source-value" [ [ 0.0953514 0.6227093 0.7960489 ] [ 0.2435865 0.7233135 3.3503906 ] [ 1.1070408 2.9533208 1.1154648 ] [ -0.3921724 3.05184 3.0312312 ] [ 2.4128487 -0.1085694 0.9609194 ] [ 2.5737279 1.5787858 2.707713 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 2.51557751231808e-12 -7.85050522425792e-12 -7.193773027392e-12 ] [ 2.85812287384512e-12 7.728900018739201e-13 1.017093762416256e-11 ] [ 6.823029357338881e-12 8.55386076078912e-12 1.9674728903424e-12 ] [ -1.5617216611248e-11 3.31586473440768e-12 -1.257708647328e-12 ] [ -8.87734022052864e-12 -7.6279628916288e-12 -1.02250911939456e-11 ] [ 1.229798730593664e-11 2.83601283647808e-12 6.53800213649856e-12 ] ] "source-value" [ [ 0.0015701 -0.0048999 -0.00449 ] [ 0.0017839 0.0004824 0.0063482 ] [ 0.0042586 0.0053389 0.001228 ] [ -0.0097475 0.0020696 -0.000785 ] [ -0.0055408 -0.004761 -0.006382 ] [ 0.0076758 0.0017701 0.0040807 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.395190601901817e-18 "source-value" -14.949604 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -5.263604848987685e-08 -4.910117422228891e-08 -5.42100021286308e-08 ] [ -2.001411589417845e-08 -3.877705040858206e-08 5.626969053743063e-08 ] [ 2.768916082863908e-08 7.057456732271692e-08 -4.360640183498639e-08 ] [ -2.603069798075608e-08 3.926233769069771e-08 3.534304549603345e-08 ] [ 3.363564832892735e-08 -2.934249831351212e-08 -1.632550444850633e-08 ] [ 3.735605320724497e-08 7.383817930968447e-09 2.252917237865945e-08 ] ] "source-value" [ [ -32.8528377 -30.6465427 -33.8352223 ] [ -12.4918287 -24.2027314 35.1207787 ] [ 17.282215 44.0491806 -27.2169755 ] [ -16.2470839 24.5056239 22.0593941 ] [ 20.9937206 -18.3141471 -10.1895785 ] [ 23.3158147 4.6086167 14.0616035 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 4.892869558318291e-18 "source-value" 30.53889 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 9.645535e-12 9.453783e-11 1.033805e-10 ] [ 3.537174000000001e-11 7.305408e-11 2.827753e-10 ] [ 9.097692e-11 2.353277e-10 1.204642e-10 ] [ 3.209695e-12 2.73021e-10 2.755149e-10 ] [ 2.067566e-10 3.58515e-11 1.282199e-10 ] [ 2.580778e-10 1.703479e-10 2.85822e-10 ] ] "source-value" [ [ 0.09645535 0.9453783 1.033805 ] [ 0.3537174 0.7305408 2.827753 ] [ 0.9097692 2.353277 1.204642 ] [ 0.03209695 2.73021 2.755149 ] [ 2.067566 0.358515 1.282199 ] [ 2.580778 1.703479 2.85822 ] ] } "instance-id" 1 }