{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.8328 1.144076 3.909989 ] [ 1.831555 2.949109 3.983595 ] [ 4.980623 2.123246 2.998848 ] [ 3.28235 2.585733 1.880535 ] [ 4.448764 2.855471 5.04642 ] [ 4.331941 4.016039 3.033368 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8328e-10 1.144076e-10 3.909989e-10 ] [ 1.831555e-10 2.949109e-10 3.983595000000001e-10 ] [ 4.980622999999999e-10 2.123246e-10 2.998848e-10 ] [ 3.28235e-10 2.585733e-10 1.880535e-10 ] [ 4.448764e-10 2.855471e-10 5.04642e-10 ] [ 4.331941e-10 4.016039e-10 3.033368e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.0473911 -1.8882246 -0.0769984 ] [ -1.0473911 1.8882246 0.0769984 ] [ 8.1232682 -11.3245437 1.325761 ] [ -7.2442896 -2.1353272 -6.6256029 ] [ 0.2374283 -1.5823812 6.2900797 ] [ -1.1164069 15.0422521 -0.9902378 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.678105533253995e-09 -3.025269308939431e-09 -1.233650363190067e-10 ] [ -1.678105533253995e-09 3.025269308939431e-09 1.233650363190067e-10 ] [ 1.30149103945281e-08 -1.814391915736793e-08 2.124103278968429e-09 ] [ -1.160663143142458e-08 -3.421171317598326e-09 -1.061538606508468e-08 ] [ 3.804020713762887e-10 -2.535254163833449e-09 1.007781863830868e-08 ] [ -1.788681034479804e-09 2.41003446387997e-08 -1.586535852192426e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.8288208 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.736623791792752e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.4164437 1.3995527 4.1202422 ] [ 0.4873244 2.4635218 4.2116306 ] [ 4.5480775 1.8870801 3.8037248 ] [ 4.5812844 3.2767192 2.0922828 ] [ 6.1655459 1.5948471 5.2730467 ] [ 3.5093571 5.0519532 1.351828 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4164437e-10 1.3995527e-10 4.1202422e-10 ] [ 4.873244e-11 2.4635218e-10 4.211630600000001e-10 ] [ 4.5480775e-10 1.8870801e-10 3.8037248e-10 ] [ 4.5812844e-10 3.2767192e-10 2.0922828e-10 ] [ 6.1655459e-10 1.5948471e-10 5.2730467e-10 ] [ 3.5093571e-10 5.0519532e-10 1.351828e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.4133712 0.4417038 0.0920702 ] [ 0.4874235 -0.4683713 0.0027682 ] [ -0.1349272 -0.2049017 0.3756789 ] [ -0.0617985 0.4511486 -0.2581885 ] [ -0.0644599 -0.0736915 -0.1446702 ] [ 0.1871333 -0.1458879 -0.0676587 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.622936723520409e-10 7.07687501678519e-10 1.475127219123802e-10 ] [ 7.809385361285088e-10 -7.50413546713703e-10 4.435145321698561e-12 ] [ -2.161772053500058e-10 -3.282887133021754e-10 6.019039505078612e-10 ] [ -9.90121119005088e-11 7.228197394266509e-10 -4.136635784594208e-10 ] [ -1.032761447591059e-10 -1.180667984516832e-10 -2.317872121664602e-10 ] [ 2.998205982331526e-10 -2.337381826376083e-10 -1.08401187333721e-10 ] ] } "relaxed-potential-energy" { "source-value" -12.794298 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.04987251351482e-18 } }