{ "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" [ [ 0.7440121 1.644003 0.1699327 ] [ 1.624629 1.787277 2.54743 ] [ 2.897237 1.241702 0.9240311 ] [ 2.052276 3.648887 1.374272 ] [ 4.460812 2.919724 2.096642 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.440121e-11 1.644003e-10 1.699327e-11 ] [ 1.624629e-10 1.787277e-10 2.54743e-10 ] [ 2.897237e-10 1.241702e-10 9.240311e-11 ] [ 2.052276e-10 3.648887e-10 1.374272e-10 ] [ 4.460812e-10 2.919724e-10 2.096642e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -55.0450951 126.9627058 48.1513963 ] [ -94.7045104 -30.5437671 75.3991874 ] [ 214.2738694 -112.3659379 -42.0510211 ] [ -70.0977297 9.8085424 -78.8055213 ] [ 5.5734658 6.1384568 -2.6940413 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.819196518552787e-08 2.034166806221763e-07 7.714704204633405e-08 ] [ -1.5173335369729e-07 -4.893650996195794e-08 1.208028162748672e-07 ] [ 3.433045868294476e-07 -1.80030080160875e-07 -6.737316344226097e-08 ] [ -1.123089446217878e-07 1.571501744687828e-08 -1.262603648570493e-07 ] [ 8.929676675158116e-09 9.83489205377841e-09 -4.316330021890983e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 37.630137 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.029012623561885e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.903659 1.9126964 -0.1048165 ] [ 1.5693326 1.6608479 3.109767 ] [ 3.2570464 0.4464346 0.8195446 ] [ 1.7300853 4.2560295 1.4342113 ] [ 4.3188427 2.9655845 1.8536014 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.03659e-11 1.9126964e-10 -1.048165e-11 ] [ 1.5693326e-10 1.6608479e-10 3.109767e-10 ] [ 3.2570464e-10 4.464346e-11 8.195446e-11 ] [ 1.7300853e-10 4.256029500000001e-10 1.4342113e-10 ] [ 4.318842700000001e-10 2.9655845e-10 1.8536014e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1e-06 -2e-06 7e-07 ] [ -2.2e-06 -1.3e-06 2.1e-06 ] [ 3e-06 -3.4e-06 -2e-06 ] [ 9e-07 7.2e-06 9e-07 ] [ -2.7e-06 -5e-07 -1.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.602176634e-15 -3.204353268e-15 1.1215236438e-15 ] [ -3.5247885948e-15 -2.0828296242e-15 3.364570931399999e-15 ] [ 4.806529901999999e-15 -5.4474005556e-15 -3.204353268e-15 ] [ 1.4419589706e-15 1.15356717648e-14 1.4419589706e-15 ] [ -4.3258769118e-15 -8.010883169999999e-16 -2.5634826144e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.044174 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.929689415863031e-18 } }