{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0221122 0.00357 0.1110342 ] [ 0.2725629 2.182164 0.260904 ] [ 0.3472204 2.881652 2.59775 ] [ 1.734388 0.2655593 2.566686 ] [ 2.338795 2.363947 0.0295877 ] [ 1.600298 1.908592 1.497057 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.21122e-12 3.57e-13 1.110342e-11 ] [ 2.725629e-11 2.182164e-10 2.60904e-11 ] [ 3.472204e-11 2.881652e-10 2.59775e-10 ] [ 1.734388e-10 2.655593e-11 2.566686e-10 ] [ 2.338795e-10 2.363947e-10 2.95877e-12 ] [ 1.600298e-10 1.908592e-10 1.497057e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.8799875 1.5913602 2.7148146 ] [ -112.0251319 21.4616616 -88.2824389 ] [ -37.3815299 26.8670784 29.3003396 ] [ 0.8661353 -33.7602953 20.9730117 ] [ 193.3304303 112.8012093 -363.5289195 ] [ -47.6698914 -128.9610143 398.8231925 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.61424864069624e-09 2.549640107711612e-09 4.349612481926504e-09 ] [ -1.794840472722163e-07 3.438537245904112e-08 -1.414440596327845e-07 ] [ -5.989181325551616e-08 4.304580488168068e-08 4.694431908862043e-08 ] [ 1.387701728109594e-09 -5.408995584096413e-08 3.360246901350486e-08 ] [ 3.097494955158639e-07 1.807274603384275e-07 -5.824375358075852e-07 ] [ -7.637558551715499e-08 -2.066183221061145e-07 6.389851948563179e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 44.774967 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.173740532449151e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5832342 0.6783372 0.632945 ] [ 0.3620597 2.8691074 0.3844123 ] [ -0.0628317 1.929262 2.3440704 ] [ 1.3535744 0.2501417 2.6580244 ] [ 2.0542481 1.8000099 -0.573576 ] [ 2.0250919 2.078626 1.6171428 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.832342000000001e-11 6.783372e-11 6.32945e-11 ] [ 3.620597e-11 2.8691074e-10 3.844123e-11 ] [ -6.283170000000001e-12 1.929262e-10 2.3440704e-10 ] [ 1.3535744e-10 2.501417e-11 2.6580244e-10 ] [ 2.0542481e-10 1.8000099e-10 -5.73576e-11 ] [ 2.0250919e-10 2.078626e-10 1.6171428e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.12e-05 8.56e-05 3.15e-05 ] [ 1.71e-05 -9.3e-06 -3.3e-06 ] [ 3.37e-05 -7.99e-05 -1.2e-05 ] [ -4.5e-06 9.8e-06 3.09e-05 ] [ 2.98e-05 -1.01e-05 -1.01e-05 ] [ -4.49e-05 4e-06 -3.69e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.998791056896e-14 1.3714631874048e-13 5.04685635552e-14 ] [ 2.739722021568e-14 -1.490024257344e-14 -5.28718284864e-15 ] [ 5.399335212096e-14 -1.2801391200192e-13 -1.92261194496e-14 ] [ -7.2097947936e-15 1.570133088384e-14 4.950725758272e-14 ] [ 4.774486329984001e-14 -1.618198387008e-14 -1.618198387008e-14 ] [ -7.193773027392e-14 6.4087064832e-15 -5.912031730752001e-14 ] ] } "relaxed-potential-energy" { "source-value" -39.006818 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.249581185140063e-18 } }