{ "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" [ [ -2.3131808 -1.603916 0.8394179 ] [ 0.3648606 0.6999253 0.4575004 ] [ 4.7482537 0.3836443 1.3258309 ] [ 1.7316347 -2.436749 -2.1451885 ] [ 0.6485064 2.9333489 -1.9900754 ] [ -0.5458518 2.4971166 0.457457 ] [ -4.6342228 -2.4733702 1.0550576 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.706124197443441e-09 -2.569756716927052e-09 1.344895734461032e-09 ] [ 5.845711231710605e-10 1.121403951966426e-09 7.329964448866484e-10 ] [ 7.607541067767098e-09 6.146659281631814e-10 2.124215271114223e-09 ] [ 2.774384632106022e-09 -3.904102278557779e-09 -3.436970861909021e-09 ] [ 1.039021792519173e-09 4.699743028229397e-09 -3.188452279509209e-09 ] [ -8.745509923815974e-10 4.000821835931585e-09 7.329269104213057e-10 ] [ -7.424843425738315e-09 -3.962775909023421e-09 1.690388620317358e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -24.840263 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.979848863312327e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0746945 2.3448799 2.7179097 ] [ 2.2506286 1.3850348 4.6253616 ] [ 2.5663937 3.9434438 1.6399842 ] [ 2.5483468 3.7393858 4.0688437 ] [ 3.4616722 1.874738 2.5674773 ] [ 4.4690912 2.3903838 4.7263015 ] [ 4.664241 3.9715701 2.881243 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0746945e-10 2.3448799e-10 2.7179097e-10 ] [ 2.2506286e-10 1.3850348e-10 4.6253616e-10 ] [ 2.5663937e-10 3.9434438e-10 1.6399842e-10 ] [ 2.5483468e-10 3.7393858e-10 4.068843700000001e-10 ] [ 3.4616722e-10 1.874738e-10 2.5674773e-10 ] [ 4.4690912e-10 2.3903838e-10 4.7263015e-10 ] [ 4.664241e-10 3.9715701e-10 2.881243e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.16e-05 2.4e-06 6.4e-06 ] [ 1.1e-06 6.2e-06 -1.86e-05 ] [ -3.49e-05 4.8e-06 -2.6e-06 ] [ -9.9e-06 -7.1e-06 -1.76e-05 ] [ -2.23e-05 3.8e-06 1.2e-06 ] [ 9.8e-06 -1.88e-05 5e-05 ] [ 2.47e-05 8.7e-06 -1.88e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.062878121728e-14 3.84522388992e-15 1.025393037312e-14 ] [ 1.76239428288e-15 9.93349504896e-15 -2.980048514688e-14 ] [ -5.591596406592e-14 7.69044777984e-15 -4.16565921408e-15 ] [ -1.586154854592e-14 -1.137545400768e-14 -2.819830852608e-14 ] [ -3.572853864384e-14 6.08827115904e-15 1.92261194496e-15 ] [ 1.570133088384e-14 -3.012092047104e-14 8.010883104e-14 ] [ 3.957376253376001e-14 1.393893660096e-14 -3.012092047104e-14 ] ] } "relaxed-potential-energy" { "source-value" -31.275942 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.010958306589679e-18 } }