{ "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" [ [ -1.4487084 1.319212 2.338349 ] [ 1.8697847 1.0960872 -0.8067662 ] [ -2.5070038 -0.8624017 -1.7293201 ] [ 2.5896856 0.3593261 -0.5108902 ] [ -1.1624508 0.1822005 -1.2920749 ] [ 2.8283626 -2.0128254 1.6825984 ] [ -2.1696699 -0.0815987 0.3181038 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.321086728836574e-09 2.11361062427881e-09 3.746448099071059e-09 ] [ 2.995725332269542e-09 1.756125286198134e-09 -1.292581944091657e-09 ] [ -4.016662876616759e-09 -1.381719841478176e-09 -2.770676234099518e-09 ] [ 4.149133723542421e-09 5.75703876663243e-10 -8.185363342358361e-10 ] [ -1.862451494590257e-09 2.919173813980704e-10 -2.070132197102498e-09 ] [ 4.531536432865102e-09 -3.224901797632409e-09 2.695819818675487e-09 ] [ -3.476194388633474e-09 -1.30735529427673e-10 5.09658471347639e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -28.352959 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.542644804030095e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1423639 1.1874152 2.5614408 ] [ 1.2226334 1.7133126 4.6272724 ] [ 2.4331995 3.5582121 5.3911946 ] [ 1.4353903 3.4333923 2.9795064 ] [ 3.8426824 2.7522521 2.2254813 ] [ 4.6162348 2.9228284 4.5256848 ] [ 3.3987287 4.6859644 3.5347406 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1423639e-10 1.1874152e-10 2.5614408e-10 ] [ 1.2226334e-10 1.7133126e-10 4.6272724e-10 ] [ 2.4331995e-10 3.5582121e-10 5.391194600000001e-10 ] [ 1.4353903e-10 3.4333923e-10 2.9795064e-10 ] [ 3.8426824e-10 2.752252100000001e-10 2.2254813e-10 ] [ 4.6162348e-10 2.9228284e-10 4.5256848e-10 ] [ 3.3987287e-10 4.6859644e-10 3.5347406e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.55e-05 -2.37e-05 3.64e-05 ] [ -4.66e-05 2.41e-05 -1.36e-05 ] [ 2.98e-05 -3.8e-05 -6e-07 ] [ 6.6e-05 -6.6e-06 3.66e-05 ] [ -1.5e-06 4e-05 -1.62e-05 ] [ -9.02e-05 4.16e-05 -4.09e-05 ] [ 1.71e-05 -3.75e-05 -1.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.08555038304e-14 -3.797158591296e-14 5.831922899712e-14 ] [ -7.466143052928e-14 3.861245656128e-14 -2.178960204288e-14 ] [ 4.774486329984001e-14 -6.08827115904e-14 -9.6130597248e-16 ] [ 1.057436569728e-13 -1.057436569728e-14 5.863966432128e-14 ] [ -2.4032649312e-15 6.4087064832e-14 -2.595526125696e-14 ] [ -1.4451633119616e-13 6.665054742528e-14 -6.552902379072e-14 ] [ 2.739722021568e-14 -6.008162327999999e-14 -2.72370025536e-15 ] ] } "relaxed-potential-energy" { "source-value" -31.651308 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.071098569534001e-18 } }