{ "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" [ [ 0.09862 0.3102875 1.608695 ] [ 0.216089 2.435481 0.8089597 ] [ 1.587261 0.9923217 0.3598848 ] [ 2.442881 2.780277 0.9615339 ] [ 1.769015 1.574471 2.844855 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.862e-12 3.102875e-11 1.608695e-10 ] [ 2.16089e-11 2.435481e-10 8.089597e-11 ] [ 1.587261e-10 9.923217e-11 3.598848e-11 ] [ 2.442881e-10 2.780277e-10 9.615339e-11 ] [ 1.769015e-10 1.574471e-10 2.844855e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -54.9248612 13.1167679 56.784268 ] [ -119.7150975 53.111056 28.2316566 ] [ 129.3410331 -110.1890895 -136.1119049 ] [ 46.8090586 47.2890381 23.7631372 ] [ -1.510133 -3.3277724 27.3328431 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.799932851532504e-08 2.101537886983991e-08 9.097842661884158e-08 ] [ -1.918047303712925e-07 8.509329222919957e-08 4.523210017097402e-08 ] [ 2.07227179342939e-07 -1.765423830641387e-07 -2.18075311843333e-07 ] [ 7.499637933057718e-08 7.576539126394045e-08 3.807274285870277e-08 ] [ -2.419499786898566e-09 -5.331679138623507e-09 4.37920421948146e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 68.744743 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.101412200375045e-17 } "relaxed-configuration-positions" { "source-value" [ [ -0.1232234 0.1935288 1.709412 ] [ -0.3368028 2.952627 0.8122327 ] [ 2.0871402 0.3920681 -0.171554 ] [ 2.5687722 3.0436013 0.9241469 ] [ 1.9179798 1.511013 3.3096907 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.232234e-11 1.935288e-11 1.709412e-10 ] [ -3.368028e-11 2.952627e-10 8.122327e-11 ] [ 2.0871402e-10 3.920681e-11 -1.71554e-11 ] [ 2.5687722e-10 3.0436013e-10 9.241469e-11 ] [ 1.9179798e-10 1.511013e-10 3.3096907e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.5e-06 1.5e-06 -1.5e-06 ] [ -4.2e-06 -3.1e-06 -8.2e-06 ] [ -1.4e-06 -5e-07 -4e-06 ] [ -5e-07 -1.1e-06 9.9e-06 ] [ 1.27e-05 3.2e-06 3.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.04141480352e-14 2.4032649312e-15 -2.4032649312e-15 ] [ -6.72914180736e-15 -4.96674752448e-15 -1.313784829056e-14 ] [ -2.24304726912e-15 -8.010883104e-16 -6.4087064832e-15 ] [ -8.010883104e-16 -1.76239428288e-15 1.586154854592e-14 ] [ 2.034764308416e-14 5.126965186560001e-15 5.928053496960001e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.147671 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.946271447337016e-18 } }