{ "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" [ [ 1.875325 2.956791 1.293332 ] [ 2.112421 5.47429 1.464888 ] [ 2.056962 4.106673 3.914817 ] [ 3.228113 2.011758 3.122182 ] [ 3.602336 4.040974 2.324239 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.875325e-10 2.956791e-10 1.293332e-10 ] [ 2.112421e-10 5.47429e-10 1.464888e-10 ] [ 2.056962e-10 4.106673e-10 3.914817000000001e-10 ] [ 3.228113e-10 2.011758e-10 3.122182e-10 ] [ 3.602336e-10 4.040974e-10 2.324239e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.4301685 -3.0457596 -5.3691038 ] [ -2.5306232 2.37196 -0.6865326 ] [ -3.1156759 2.3093645 5.681265 ] [ -0.0912807 -5.1174557 2.2269641 ] [ 9.1677483 3.4818908 -1.8525928 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.495735776104605e-09 -4.879844823697159e-09 -8.602252583008439e-09 ] [ -4.054505327094083e-09 3.800298857472768e-09 -1.099946481137038e-09 ] [ -4.991863084969999e-09 3.700009810805482e-09 9.102389959569312e-09 ] [ -1.462478034702586e-10 -8.1990678805197e-09 3.567989816380913e-09 ] [ 1.468835199163894e-08 5.578604035938609e-09 -2.968180872022411e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.960349 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.115170844040866e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1524437 2.8614579 0.8545949 ] [ 1.6781518 5.1822912 1.770539 ] [ 2.2573713 4.3778258 4.1088126 ] [ 2.7316641 2.0569919 3.1928672 ] [ 4.0555261 4.1119192 2.1926443 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1524437e-10 2.8614579e-10 8.545949000000001e-11 ] [ 1.6781518e-10 5.1822912e-10 1.770539e-10 ] [ 2.2573713e-10 4.3778258e-10 4.108812600000001e-10 ] [ 2.7316641e-10 2.0569919e-10 3.1928672e-10 ] [ 4.0555261e-10 4.1119192e-10 2.1926443e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.42e-05 -2.06e-05 -2.36e-05 ] [ -7e-06 1.18e-05 3e-06 ] [ -6e-06 6.6e-06 1.24e-05 ] [ 7e-07 -6.1e-06 3.4e-06 ] [ 2.66e-05 8.3e-06 4.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.275090801536e-14 -3.300483838848e-14 -3.781136825088e-14 ] [ -1.12152363456e-14 1.890568412544e-14 4.8065298624e-15 ] [ -9.6130597248e-15 1.057436569728e-14 1.986699009792e-14 ] [ 1.12152363456e-15 -9.77327738688e-15 5.44740051072e-15 ] [ 4.261789811328e-14 1.329806595264e-14 7.69044777984e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.338031 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.656335157330565e-18 } }