{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 3.032432 2.348999 1.593337 ] [ 4.810482 1.062628 3.508091 ] [ 5.121871 3.223017 1.668157 ] [ 3.284691 4.649431 1.699114 ] [ 3.943916 3.285754 3.641374 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.032432e-10 2.348999e-10 1.593337e-10 ] [ 4.810482000000001e-10 1.062628e-10 3.508091e-10 ] [ 5.121871e-10 3.223017e-10 1.668157e-10 ] [ 3.284691e-10 4.649431e-10 1.699114e-10 ] [ 3.943916e-10 3.285754e-10 3.641374e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.5179293 -3.6197763 0.6629311 ] [ -0.9283685 3.1841657 -3.5026735 ] [ 4.3246162 -2.2552985 0.1197088 ] [ -0.9738502 2.2989726 -0.1351778 ] [ -0.9044681 0.3919365 2.8552114 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.431990836487309e-09 -5.799520960385927e-09 1.062132709621227e-09 ] [ -1.487410306187165e-09 5.101595841293267e-09 -5.611901591995709e-09 ] [ 6.928798969572937e-09 -3.613386529625309e-09 1.91794640664023e-10 ] [ -1.560280022601404e-09 3.68336015157979e-09 -2.165787108111782e-10 ] [ -1.449117644079397e-09 6.279514971381792e-10 4.574552952521637e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.402096 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.98703482601172e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.9665295 2.1682855 1.7442768 ] [ 4.7516269 1.2166807 3.1615915 ] [ 5.3176195 3.1516017 1.7344727 ] [ 3.3257209 4.6112443 1.6824374 ] [ 3.8318954 3.4220167 3.7872946 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9665295e-10 2.1682855e-10 1.7442768e-10 ] [ 4.7516269e-10 1.2166807e-10 3.1615915e-10 ] [ 5.3176195e-10 3.1516017e-10 1.7344727e-10 ] [ 3.3257209e-10 4.6112443e-10 1.6824374e-10 ] [ 3.8318954e-10 3.4220167e-10 3.7872946e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.83e-05 -8.9e-06 8.4e-06 ] [ 1.01e-05 3.66e-05 -1.57e-05 ] [ -3.37e-05 -2.89e-05 -8e-07 ] [ 1.96e-05 2.23e-05 -1.39e-05 ] [ -1.43e-05 -2.11e-05 2.21e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.931983216064e-14 -1.425937192512e-14 1.345828361472e-14 ] [ 1.618198387008e-14 5.863966432128e-14 -2.515417294656e-14 ] [ -5.399335212096e-14 -4.630290434112001e-14 -1.28174129664e-15 ] [ 3.140266176767999e-14 3.572853864384e-14 -2.227025502912e-14 ] [ -2.291112567744e-14 -3.380592669888e-14 3.540810331968e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.299971 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.2911079214318e-18 } }