{ "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" [ [ 0.3126518 0.5217928 0.1846885 ] [ 0.8333114 2.588069 2.680495 ] [ 2.642381 0.0430457 2.992394 ] [ 2.45603 2.243401 1.184533 ] [ 2.245972 1.834771 2.762862 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.126518e-11 5.217928e-11 1.846885e-11 ] [ 8.333114000000001e-11 2.588069e-10 2.680495e-10 ] [ 2.642381e-10 4.30457e-12 2.992394e-10 ] [ 2.45603e-10 2.243401e-10 1.184533e-10 ] [ 2.245972e-10 1.834771e-10 2.762862e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.0121887 2.2406647 1.7460298 ] [ -28.7692618 13.4160147 -1.1137174 ] [ 1.9406228 -10.6540351 1.154043 ] [ 2.8224361 4.1418795 -26.1002901 ] [ 21.9940141 -9.1445238 24.3139347 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.223881691777945e-09 3.589940597391846e-09 2.7974481247801e-09 ] [ -4.609343865363453e-08 2.149482509664913e-08 -1.784371980458162e-09 ] [ 3.109220479951434e-09 -1.706964595440259e-08 1.848980713997894e-09 ] [ 4.522041133121931e-09 6.636022501070794e-09 -4.181727459431769e-08 ] [ 3.523829518856555e-08 -1.465114224070918e-08 3.895521773599787e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 4.0252006 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.449082295350133e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.559249 0.5960196 0.9738465 ] [ 0.5119708 2.6933737 2.1398079 ] [ 2.4794085 -0.0703484 2.2503872 ] [ 2.5075747 1.9850136 1.0245997 ] [ 2.4321432 2.027021 3.4163311 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.59249e-11 5.960196e-11 9.738465e-11 ] [ 5.119708e-11 2.6933737e-10 2.1398079e-10 ] [ 2.4794085e-10 -7.034840000000001e-12 2.2503872e-10 ] [ 2.5075747e-10 1.9850136e-10 1.0245997e-10 ] [ 2.4321432e-10 2.027021e-10 3.4163311e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.54e-05 5.6e-06 2.39e-05 ] [ 3.08e-05 -9e-06 -1.59e-05 ] [ -1.07e-05 2.97e-05 -8.2e-06 ] [ -3.15e-05 -3.5e-06 1.39e-05 ] [ -1.4e-05 -2.27e-05 -1.38e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.069528616832e-14 8.972189076479999e-15 3.829202123712e-14 ] [ 4.934703992064001e-14 -1.44195895872e-14 -2.547460827072e-14 ] [ -1.714328984256e-14 4.758464563776e-14 -1.313784829056e-14 ] [ -5.04685635552e-14 -5.6076181728e-15 2.227025502912e-14 ] [ -2.24304726912e-14 -3.636940929216e-14 -2.211003736704e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.3401 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.137319633913408e-18 } }