{ "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" [ [ 2.975716 3.919 3.294603 ] [ 5.229011 2.380728 1.260294 ] [ 3.72512 0.5184044 0.8589665 ] [ 3.15133 1.64182 3.064405 ] [ 5.039876 3.004083 3.766304 ] [ 5.090657 4.730463 1.850516 ] [ 3.207695 3.468122 0.7711985 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.975716e-10 3.919e-10 3.294603e-10 ] [ 5.229011e-10 2.380728e-10 1.260294e-10 ] [ 3.72512e-10 5.184044e-11 8.589665e-11 ] [ 3.151330000000001e-10 1.64182e-10 3.064405e-10 ] [ 5.039876e-10 3.004083e-10 3.766304e-10 ] [ 5.090657000000001e-10 4.730463000000001e-10 1.850516e-10 ] [ 3.207695e-10 3.468122e-10 7.711985e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2183769 1.4879608 -0.3816493 ] [ 0.1351532 -1.0169924 0.1180577 ] [ 0.073109 1.5282691 0.6726635 ] [ -0.138437 -1.7768249 -0.5424957 ] [ 1.2427969 -0.1935645 -0.3512257 ] [ -0.141824 0.2388283 0.0996003 ] [ 0.0475787 -0.2676765 0.3850491 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.952055000585354e-09 2.383976026067947e-09 -6.114695908424563e-10 ] [ 2.165392990503288e-10 -1.629401460235581e-09 1.891492884037818e-10 ] [ 1.17133531535106e-10 2.448557042484209e-09 1.077725742244659e-09 ] [ -2.21800526681058e-10 -2.846787337489386e-09 -8.691739345854737e-10 ] [ 1.991180153987634e-09 -3.101245190718929e-10 -5.627256098002936e-10 ] [ -2.27227098940416e-10 3.826451217979421e-10 1.595772733993902e-10 ] [ 7.622948141609579e-11 -4.28865033770901e-10 6.169166709627293e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -16.96693106491639 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.718402050289778e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6805799 3.8609172 3.178106 ] [ 5.6812815 2.2718114 1.0267598 ] [ 3.6177805 0.9843865 1.1682002 ] [ 3.0062903 1.4521512 3.3429949 ] [ 5.0525007 2.8237097 3.4092247 ] [ 5.0266162 4.8648107 1.953287 ] [ 3.3543559 3.4048338 0.7877143 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6805799e-10 3.8609172e-10 3.178106e-10 ] [ 5.6812815e-10 2.2718114e-10 1.0267598e-10 ] [ 3.6177805e-10 9.843865000000001e-11 1.1682002e-10 ] [ 3.0062903e-10 1.4521512e-10 3.3429949e-10 ] [ 5.052500700000001e-10 2.8237097e-10 3.4092247e-10 ] [ 5.026616200000001e-10 4.8648107e-10 1.953287e-10 ] [ 3.3543559e-10 3.4048338e-10 7.877143e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.58e-05 1.79e-05 2.88e-05 ] [ 7.99e-05 -6.92e-05 -8.73e-05 ] [ 8.3e-06 4.64e-05 6.41e-05 ] [ -6.3e-05 1.3e-06 -6.43e-05 ] [ 4.43e-05 -3.06e-05 4.29e-05 ] [ -5.2e-06 0.0001107 2.64e-05 ] [ -4.86e-05 -7.65e-05 -1.05e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.53143908172e-14 2.86789617486e-14 4.614268705919999e-14 ] [ 1.280139130566e-13 -1.108706230728e-13 -1.398700201482e-13 ] [ 1.32980660622e-14 7.43409958176e-14 1.026995222394e-13 ] [ -1.00937127942e-13 2.0828296242e-15 -1.030199575662e-13 ] [ 7.09764248862e-14 -4.90266050004e-14 6.873337759859999e-14 ] [ -8.331318496799998e-15 1.773609533838e-13 4.22974631376e-14 ] [ -7.786578441239999e-14 -1.22566512501e-13 -1.6822854657e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.04793206491639 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.891597504642841e-18 } }