{ "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" [ [ 0.0409622 2.87289 0.6143003 ] [ 0.4467191 2.12103 2.019138 ] [ 1.9155 0.4332474 1.113336 ] [ 2.832667 2.287938 0.2396185 ] [ 2.613397 2.701371 2.225579 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.09622e-12 2.87289e-10 6.143003e-11 ] [ 4.467191e-11 2.12103e-10 2.019138e-10 ] [ 1.9155e-10 4.332474e-11 1.113336e-10 ] [ 2.832667e-10 2.287938e-10 2.396185e-11 ] [ 2.613397e-10 2.701371e-10 2.225579e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.7272336 9.7402993 -20.7973122 ] [ 5.771554 -11.9719402 20.4577479 ] [ -1.4894255 0.7280475 1.1015268 ] [ -2.0117683 0.8631317 -5.3001437 ] [ -0.5431265 0.6404616 4.5381812 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.767333292580219e-09 1.56056798180546e-08 -3.332096738231861e-08 ] [ 9.247048884484723e-09 -1.918116269405568e-08 3.27769253996003e-08 ] [ -2.38632271452335e-09 1.166460683331888e-09 1.764840486144638e-09 ] [ -3.223208136726561e-09 1.382889430411359e-09 -8.491766323020409e-09 ] [ -8.701845804369312e-10 1.026132602040161e-09 7.27096781959409e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.3954072 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.345092513793599e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5975061 2.7867495 0.4920446 ] [ 0.2544444 1.7823665 2.6648425 ] [ 1.7137796 0.6846857 1.0796069 ] [ 2.8852537 2.3842263 -0.1800535 ] [ 2.3982615 2.7784485 2.1555313 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.975061e-11 2.7867495e-10 4.920446e-11 ] [ 2.544444e-11 1.7823665e-10 2.6648425e-10 ] [ 1.7137796e-10 6.846857e-11 1.0796069e-10 ] [ 2.8852537e-10 2.3842263e-10 -1.800535e-11 ] [ 2.3982615e-10 2.7784485e-10 2.1555313e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.26e-05 1.2e-06 6.3e-06 ] [ 1.73e-05 -3.8e-06 -1.64e-05 ] [ 3e-07 1.7e-05 3.7e-06 ] [ -1.83e-05 -1.01e-05 1.86e-05 ] [ -1.19e-05 -4.4e-06 -1.22e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.018742542208e-14 1.92261194496e-15 1.009371271104e-14 ] [ 2.771765553984e-14 -6.08827115904e-15 -2.627569658112e-14 ] [ 4.8065298624e-16 2.72370025536e-14 5.928053496960001e-15 ] [ -2.931983216064e-14 -1.618198387008e-14 2.980048514688e-14 ] [ -1.906590178752e-14 -7.04957713152e-15 -1.954655477376e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.096417 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.899365623764767e-18 } }