{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.317023 1.146232 2.35214 ] [ 1.137751 1.512768 4.697187 ] [ 2.525224 3.828296 5.439775 ] [ 1.195151 3.273987 3.261847 ] [ 3.958209 2.788765 2.245111 ] [ 4.201729 2.884975 4.427405 ] [ 3.756146 4.818354 3.421856 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.317023e-10 1.146232e-10 2.35214e-10 ] [ 1.137751e-10 1.512768e-10 4.697187e-10 ] [ 2.525224e-10 3.828296e-10 5.439775e-10 ] [ 1.195151e-10 3.273987e-10 3.261847e-10 ] [ 3.958209e-10 2.788765e-10 2.245111e-10 ] [ 4.201729000000001e-10 2.884975e-10 4.427405e-10 ] [ 3.756146e-10 4.818354e-10 3.421856e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.8176375 -0.7798653 0.1908583 ] [ 1.9268288 1.196645 1.7089555 ] [ -5.764196 -2.7059512 1.7147815 ] [ 9.5081087 4.1772566 -1.5363795 ] [ -3.6881012 -2.7365245 -4.7576209 ] [ 3.9122726 -5.5915394 5.2508448 ] [ -5.0772755 6.4399789 -2.5714396 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.30999968678936e-09 -1.249481951033178e-09 3.057887061456327e-10 ] [ 3.087120055644119e-09 1.917236642397216e-09 2.738048548087575e-09 ] [ -9.235260068908876e-09 -4.335411749665705e-09 2.747382829080355e-09 ] [ 1.523366946716508e-08 6.692702863602497e-09 -2.461551315576394e-09 ] [ -5.908989517784425e-09 -4.38439557614641e-09 -7.622548976609455e-09 ] [ 6.268151693916431e-09 -8.958633700962059e-09 8.412780778009251e-09 ] [ -8.13469210346063e-09 1.03179836320253e-08 -4.119900408919304e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.800951 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.852026752020638e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0746181 1.0198882 2.4851992 ] [ 1.0805923 1.5852734 4.6767279 ] [ 2.4273806 3.5271957 5.3407724 ] [ 1.4894158 3.5256241 2.9674247 ] [ 3.8166868 2.7369889 2.2786252 ] [ 4.734478 2.9291306 4.5936508 ] [ 3.4680614 4.9292761 3.5029208 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0746181e-10 1.0198882e-10 2.4851992e-10 ] [ 1.0805923e-10 1.5852734e-10 4.6767279e-10 ] [ 2.4273806e-10 3.5271957e-10 5.3407724e-10 ] [ 1.4894158e-10 3.5256241e-10 2.9674247e-10 ] [ 3.8166868e-10 2.7369889e-10 2.2786252e-10 ] [ 4.734478000000001e-10 2.9291306e-10 4.5936508e-10 ] [ 3.4680614e-10 4.9292761e-10 3.5029208e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.24e-05 -1.67e-05 8.62e-05 ] [ -2.58e-05 8.41e-05 -4.15e-05 ] [ -3.93e-05 -7.71e-05 -3.94e-05 ] [ 7.2e-06 -2.27e-05 5.8e-05 ] [ 4.1e-06 8.69e-05 3.53e-05 ] [ -3.18e-05 2.7e-06 -9.22e-05 ] [ 3.33e-05 -5.73e-05 -6.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.395405492992e-14 -2.675634956736e-14 1.3810762471296e-13 ] [ -4.133615681664e-14 1.3474305380928e-13 -6.64903297632e-14 ] [ -6.296554119743999e-14 -1.2352781746368e-13 -6.312575885952001e-14 ] [ 1.153567166976e-14 -3.636940929216e-14 9.29262440064e-14 ] [ 6.568924145279999e-15 1.3922914834752e-13 5.655683471424e-14 ] [ -5.094921654144e-14 4.32587687616e-15 -1.4772068443776e-13 ] [ 5.335248147264001e-14 -9.180472037184001e-14 -1.025393037312e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.198393 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.877009952553038e-18 } }