{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.344878 2.219137 2.797465 ] [ 2.001288 4.461966 3.139291 ] [ 3.23388 2.535754 1.187329 ] [ 4.3257 4.424828 2.075195 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.344878e-10 2.219137e-10 2.797465e-10 ] [ 2.001288e-10 4.461966000000001e-10 3.139291e-10 ] [ 3.23388e-10 2.535754e-10 1.187329e-10 ] [ 4.3257e-10 4.424828e-10 2.075195e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.7133103 0.3870799 -0.4823605 ] [ 0.6449746 -0.0698895 -0.2226357 ] [ -0.3693518 -0.127959 0.3900601 ] [ -0.9889332 -0.1892315 0.3149361 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.142849086035834e-09 6.201703661616019e-10 -7.728267158973985e-10 ] [ 1.033363225129832e-09 -1.119753229394016e-10 -3.567017134954425e-10 ] [ -5.917668188103975e-10 -2.050129182209472e-10 6.249451729269101e-10 ] [ -1.584445652572931e-09 -3.031822852189152e-10 5.045832564659309e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -3.5793966203271186 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.734825581658643e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.4306683 2.4064309 2.5890612 ] [ 2.1039926 4.522294 3.3707869 ] [ 3.3488891 2.298541 1.2288654 ] [ 4.0221961 4.4144191 2.0105664 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4306683e-10 2.4064309e-10 2.5890612e-10 ] [ 2.1039926e-10 4.522294e-10 3.3707869e-10 ] [ 3.3488891e-10 2.298541e-10 1.2288654e-10 ] [ 4.022196100000001e-10 4.4144191e-10 2.0105664e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.6e-06 -4.8e-06 -3.1e-06 ] [ 6e-07 5.8e-06 1e-07 ] [ -5.3e-06 -1.3e-06 -0.0 ] [ 1e-07 2e-07 2.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.370012455680001e-15 -7.69044777984e-15 -4.96674752448e-15 ] [ 9.6130597248e-16 9.292624400640001e-15 1.6021766208e-16 ] [ -8.491536090240001e-15 -2.08282960704e-15 0.0 ] [ 1.6021766208e-16 3.2043532416e-16 4.646312200320001e-15 ] ] } "relaxed-potential-energy" { "source-value" -3.86421462032712 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.19115432244166e-19 } }