{ "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" [ [ 1.999551 1.685791 2.486539 ] [ 2.806467 1.943327 4.558328 ] [ 1.52714 3.922099 3.002179 ] [ 4.336396 2.072479 2.061694 ] [ 5.046676 1.88237 4.081611 ] [ 3.556935 4.352885 1.849563 ] [ 3.300335 4.140991 4.307093 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.999551e-10 1.685791e-10 2.486539e-10 ] [ 2.806467e-10 1.943327e-10 4.558328e-10 ] [ 1.52714e-10 3.922099e-10 3.002179e-10 ] [ 4.336396e-10 2.072479e-10 2.061694e-10 ] [ 5.046676e-10 1.88237e-10 4.081611e-10 ] [ 3.556935e-10 4.352885e-10 1.849563e-10 ] [ 3.300335e-10 4.140991e-10 4.307093e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.470756 -3.8945968 -4.1366495 ] [ -0.2842462 -3.4095213 6.1652512 ] [ -6.3537153 1.4441644 -2.7095848 ] [ -0.4513027 -0.8341857 -8.1798382 ] [ 3.1113182 -0.6889759 4.9511956 ] [ 2.5001161 1.5432883 -1.6635689 ] [ 3.9485859 5.8398271 5.5731947 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.958587498901326e-09 -6.239831940402493e-09 -6.62764311734401e-09 ] [ -4.55412616191241e-10 -5.462655314979624e-09 9.877821333999145e-09 ] [ -1.017977410887926e-08 2.31380643827166e-09 -4.341233418635044e-09 ] [ -7.230666348439163e-10 -1.336512825945683e-09 -1.310554552596676e-08 ] [ 4.984881279909539e-09 -1.103861079274639e-09 7.932689835327828e-09 ] [ 4.005627564705675e-09 2.472620433414177e-09 -2.665331198669973e-09 ] [ 6.326332014200527e-09 9.356434449134264e-09 8.92924225150647e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.900386 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.227087346929563e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9797977 1.5885942 2.5674201 ] [ 2.7151691 1.6828396 4.9172505 ] [ 1.4513524 3.9878451 2.7563821 ] [ 4.232777 2.0556474 1.7479585 ] [ 5.0243447 2.1423063 4.0662241 ] [ 3.7560935 4.4553958 1.8977586 ] [ 3.4139656 4.0873136 4.394013 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9797977e-10 1.5885942e-10 2.5674201e-10 ] [ 2.7151691e-10 1.6828396e-10 4.9172505e-10 ] [ 1.4513524e-10 3.9878451e-10 2.7563821e-10 ] [ 4.232776999999999e-10 2.0556474e-10 1.7479585e-10 ] [ 5.0243447e-10 2.1423063e-10 4.066224100000001e-10 ] [ 3.7560935e-10 4.4553958e-10 1.8977586e-10 ] [ 3.4139656e-10 4.0873136e-10 4.394013000000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.7e-06 4.5e-06 2.52e-05 ] [ -1.01e-05 9.1e-06 -5.6e-06 ] [ 5.1e-06 -2.05e-05 -1.33e-05 ] [ -8.6e-06 -8e-07 -1.67e-05 ] [ -2.3e-06 1.14e-05 -1.13e-05 ] [ 1.66e-05 7.1e-06 9.2e-06 ] [ -2.5e-06 -1.06e-05 1.25e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.72370025536e-15 7.2097947936e-15 4.037485084416e-14 ] [ -1.618198387008e-14 1.457980724928e-14 -8.972189076479999e-15 ] [ 8.17110076608e-15 -3.28446207264e-14 -2.130894905664e-14 ] [ -1.377871893888e-14 -1.28174129664e-15 -2.675634956736e-14 ] [ -3.68500622784e-15 1.826481347712e-14 -1.810459581504e-14 ] [ 2.659613190528e-14 1.137545400768e-14 1.474002491136e-14 ] [ -4.005441552e-15 -1.698307218048e-14 2.002720776e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.305811 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.932914240898347e-18 } }