{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.570437 1.678388 2.565083 ] [ 2.924882 3.183881 4.210831 ] [ 1.144354 3.791418 3.165706 ] [ 4.144212 1.310941 0.7169232 ] [ 4.636642 2.415393 2.866782 ] [ 3.821758 3.649635 1.198039 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.570437e-10 1.678388e-10 2.565083e-10 ] [ 2.924882e-10 3.183881e-10 4.210831e-10 ] [ 1.144354e-10 3.791418000000001e-10 3.165706e-10 ] [ 4.144212e-10 1.310941e-10 7.169232e-11 ] [ 4.636642e-10 2.415393e-10 2.866782e-10 ] [ 3.821758e-10 3.649635e-10 1.198039e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.6765484 -1.9850916 -2.214218 ] [ 2.15949 1.1060952 4.5739059 ] [ -2.1673397 0.174558 -1.8608871 ] [ 0.1444318 -0.2233483 -0.3907056 ] [ 5.6158481 -0.3879363 1.9947991 ] [ -1.0758818 1.3157231 -2.1028943 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.492656512519646e-09 -3.180467351666466e-09 -3.547568312954534e-09 ] [ 3.459884390851392e-09 1.7721598698191e-09 7.328205098719182e-09 ] [ -3.472460996671685e-09 2.796727465736064e-10 -2.981469805568312e-09 ] [ 2.314052532600614e-10 -3.578434245554246e-10 -6.259793779356365e-10 ] [ 8.9975805317841e-09 -6.215424702196551e-10 3.196020481212881e-09 ] [ -1.723752666704222e-09 2.108020790266501e-09 -3.369208083473582e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.312212 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.453286807913321e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3246686 2.2170119 2.1417746 ] [ 2.9666324 2.7769111 4.4767116 ] [ 1.0324372 3.7398535 3.5117567 ] [ 4.2937091 1.0906815 1.0768623 ] [ 4.7488723 2.7368784 2.8560727 ] [ 3.8759653 3.4683196 0.6601863 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3246686e-10 2.2170119e-10 2.1417746e-10 ] [ 2.9666324e-10 2.7769111e-10 4.4767116e-10 ] [ 1.0324372e-10 3.7398535e-10 3.5117567e-10 ] [ 4.2937091e-10 1.0906815e-10 1.0768623e-10 ] [ 4.748872300000001e-10 2.7368784e-10 2.8560727e-10 ] [ 3.8759653e-10 3.4683196e-10 6.601863e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.3e-06 4.1e-06 6.4e-06 ] [ -8.2e-06 9e-07 -1.21e-05 ] [ 4.7e-06 2e-06 6.1e-06 ] [ 1.45e-05 -1.78e-05 -4e-07 ] [ 2.4e-06 -2.9e-06 2.5e-06 ] [ -8.2e-06 1.38e-05 -2.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.491536090240001e-15 6.568924145279999e-15 1.025393037312e-14 ] [ -1.313784829056e-14 1.44195895872e-15 -1.938633711168e-14 ] [ 7.53023011776e-15 3.2043532416e-15 9.77327738688e-15 ] [ 2.32315610016e-14 -2.851874385024e-14 -6.408706483200001e-16 ] [ 3.84522388992e-15 -4.646312200320001e-15 4.005441552e-15 ] [ -1.313784829056e-14 2.211003736704e-14 -4.005441552e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.370823 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.783112649465492e-18 } }