{ "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" [ [ 2.534514 2.228148 2.279478 ] [ 2.568469 4.258609 2.123082 ] [ 4.573888 5.069598 2.661577 ] [ 4.270042 3.378559 1.121613 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.534514e-10 2.228148e-10 2.279478e-10 ] [ 2.568469e-10 4.258609e-10 2.123082e-10 ] [ 4.573888e-10 5.069598e-10 2.661577e-10 ] [ 4.270042e-10 3.378559e-10 1.121613e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3822721 -5.6227313 0.1405328 ] [ -2.8231637 6.4766319 0.3504606 ] [ 1.0681626 0.4741341 0.3306721 ] [ 1.3727289 -1.3280347 -0.8216655 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.124674264501114e-10 -9.008608708120443e-09 2.251583684705952e-10 ] [ -4.523206914096986e-09 1.037670829719902e-08 5.614997844576203e-10 ] [ 1.711385159032688e-09 7.596465764026194e-10 5.297951121357114e-10 ] [ 2.199354168396522e-09 -2.127746165481199e-09 -1.316453265063927e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.20773 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.955893976018082e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.0706539 2.5225697 2.6528702 ] [ 2.354911 4.546806 1.7901593 ] [ 4.3723272 4.4174394 2.915942 ] [ 4.1490209 3.4480989 0.8267785 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0706539e-10 2.5225697e-10 2.6528702e-10 ] [ 2.354911e-10 4.546806e-10 1.7901593e-10 ] [ 4.3723272e-10 4.4174394e-10 2.915942e-10 ] [ 4.1490209e-10 3.4480989e-10 8.267785e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.5e-06 -6.1e-06 4e-06 ] [ -8.4e-06 6e-06 -9e-07 ] [ 4.4e-06 2.7e-06 5e-06 ] [ 5.5e-06 -2.6e-06 -8.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.403264951e-15 -9.773277467399999e-15 6.408706535999999e-15 ] [ -1.34582837256e-14 9.613059803999999e-15 -1.4419589706e-15 ] [ 7.0495771896e-15 4.3258769118e-15 8.010883169999999e-15 ] [ 8.811971486999999e-15 -4.165659248399999e-15 -1.29776307354e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.70586 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.516356190887524e-18 } }