{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.407843 0.245212 0.8461342 ] [ 0.3575484 2.529829 0.7913405 ] [ 2.613551 0.2346879 2.890384 ] [ 2.035903 2.65608 2.375902 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.407843e-10 2.45212e-11 8.461342e-11 ] [ 3.575484e-11 2.529829e-10 7.913405e-11 ] [ 2.613551e-10 2.346879e-11 2.890384e-10 ] [ 2.035903e-10 2.65608e-10 2.375902e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.0303361 -6.5246032 -4.8474689 ] [ -1.587144 0.4796744 -1.3878845 ] [ 0.8520666 -0.451339 1.1864997 ] [ 2.7654134 6.4962678 5.0488537 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.252957031786251e-09 -1.045356670703686e-08 -7.766501341635093e-09 ] [ -2.542885010642996e-09 7.685231092762675e-10 -2.223636098270697e-09 ] [ 1.365161185884545e-09 -7.231247938552511e-10 1.900982079926214e-09 ] [ 4.430680696327039e-09 1.040816839161585e-08 8.089155359979578e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.7779999 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.25737635476474e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.1851098 0.0378109 0.7795487 ] [ 0.5747806 2.3978489 0.7514154 ] [ 2.6326417 0.4350555 2.7004652 ] [ 2.0223134 2.7950936 2.6723313 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1851098e-10 3.78109e-12 7.795487e-11 ] [ 5.747806e-11 2.3978489e-10 7.514154e-11 ] [ 2.6326417e-10 4.350555e-11 2.7004652e-10 ] [ 2.0223134e-10 2.7950936e-10 2.672331300000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.1e-06 -1.8e-06 -9e-07 ] [ 7e-07 1e-07 -1e-07 ] [ 5e-07 2e-07 -3e-07 ] [ -1e-07 1.6e-06 1.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.76239428288e-15 -2.88391791744e-15 -1.44195895872e-15 ] [ 1.12152363456e-15 1.6021766208e-16 -1.6021766208e-16 ] [ 8.010883104e-16 3.2043532416e-16 -4.8065298624e-16 ] [ -1.6021766208e-16 2.56348259328e-15 2.08282960704e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.104631 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.298505030841092e-18 } }