{ "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" [ [ 1.442259 2.324158 2.548252 ] [ 2.158618 1.41899 4.605472 ] [ 2.34516 4.213318 2.000238 ] [ 2.029556 3.900131 4.500233 ] [ 3.591834 1.471441 2.657937 ] [ 4.338938 2.513725 4.512162 ] [ 5.128703 3.807673 2.402827 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.442259e-10 2.324158e-10 2.548252e-10 ] [ 2.158618e-10 1.41899e-10 4.605472e-10 ] [ 2.34516e-10 4.213318e-10 2.000238e-10 ] [ 2.029556e-10 3.900131e-10 4.500233e-10 ] [ 3.591834e-10 1.471441e-10 2.657937e-10 ] [ 4.338938e-10 2.513725e-10 4.512162e-10 ] [ 5.128703e-10 3.807673e-10 2.402827e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.9270825 -5.2648385 -12.5685124 ] [ -8.8030416 -11.2312079 14.0651308 ] [ 1.1274434 10.4323069 -5.9904904 ] [ -3.0081841 13.4458262 10.9416385 ] [ 9.523816 -14.1396683 -11.8531629 ] [ 11.9724227 3.3279132 7.2737633 ] [ 1.1146262 3.4296686 -1.8683669 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.910929273585282e-08 -8.43520115698774e-09 -2.01369767255149e-08 ] [ -1.410402744344983e-08 -1.799437872072426e-08 2.2534823736254e-08 ] [ 1.806363456755263e-09 1.671439821619052e-08 -9.59782366600684e-09 ] [ -4.81964223608229e-09 2.154258838498011e-08 1.753043739794518e-08 ] [ 1.525883533600097e-08 -2.265424597612688e-08 -1.899086048091393e-08 ] [ 1.918193574427521e-08 5.331904725091714e-09 1.165385350449306e-08 ] [ 1.785828038571145e-09 5.494934848011866e-09 -2.993453766256572e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 2.4285382 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.890947126759715e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.5782106 1.8575152 2.218014 ] [ 1.2853364 1.7585931 4.6179009 ] [ 2.377963 4.2432243 2.4501413 ] [ 2.4137277 3.8732503 4.9495251 ] [ 3.8583679 1.1714231 1.7876883 ] [ 4.7832039 3.4026403 4.8112044 ] [ 4.7382585 3.3427897 2.392647 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5782106e-10 1.8575152e-10 2.218014e-10 ] [ 1.2853364e-10 1.7585931e-10 4.617900900000001e-10 ] [ 2.377963e-10 4.2432243e-10 2.4501413e-10 ] [ 2.4137277e-10 3.8732503e-10 4.9495251e-10 ] [ 3.858367900000001e-10 1.1714231e-10 1.7876883e-10 ] [ 4.7832039e-10 3.4026403e-10 4.811204400000001e-10 ] [ 4.7382585e-10 3.3427897e-10 2.392647e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.23e-05 -6e-07 -1.59e-05 ] [ 6.2e-06 -2.5e-06 -1.2e-06 ] [ -8.5e-06 -9.3e-06 -9.9e-06 ] [ 1.03e-05 8.4e-06 1.06e-05 ] [ -3.7e-06 -1.5e-06 -4e-07 ] [ 4e-06 3e-06 6.3e-06 ] [ 3.9e-06 2.5e-06 1.05e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.970677243584e-14 -9.6130597248e-16 -2.547460827072e-14 ] [ 9.93349504896e-15 -4.005441552e-15 -1.92261194496e-15 ] [ -1.36185012768e-14 -1.490024257344e-14 -1.586154854592e-14 ] [ 1.650241919424e-14 1.345828361472e-14 1.698307218048e-14 ] [ -5.928053496960001e-15 -2.4032649312e-15 -6.408706483200001e-16 ] [ 6.4087064832e-15 4.8065298624e-15 1.009371271104e-14 ] [ 6.24848882112e-15 4.005441552e-15 1.68228545184e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.350653 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.619663397141338e-18 } }