{ "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" [ [ 1.247505 0.2174365 0.42208 ] [ 0.0506875 0.0915851 2.362651 ] [ 1.429891 2.603248 1.463699 ] [ 0.6097234 2.164425 2.912732 ] [ 2.744149 0.6540612 0.6213704 ] [ 2.652131 2.68783 0.0915898 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.247505e-10 2.174365e-11 4.2208e-11 ] [ 5.068750000000001e-12 9.15851e-12 2.362651e-10 ] [ 1.429891e-10 2.603248e-10 1.463699e-10 ] [ 6.097234e-11 2.164425e-10 2.912732e-10 ] [ 2.744149e-10 6.540612e-11 6.213704e-11 ] [ 2.652131e-10 2.68783e-10 9.15898e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -16.909929 -10.3185793 -5.4837153 ] [ -2.3720522 -3.2107303 1.7498852 ] [ -3.709901 11.7382504 -1.0820486 ] [ -6.9475791 -1.3971433 14.484669 ] [ 20.1388061 -4.6483795 1.236095 ] [ 9.8006552 7.8365819 -10.9048853 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.709269290318793e-08 -1.653218651433083e-08 -8.78588044878326e-09 ] [ -3.800446578157206e-09 -5.14415702235417e-09 2.803625156523932e-09 ] [ -5.94391664768254e-09 1.880675035997625e-08 -1.733632969489371e-09 ] [ -1.11312488051787e-08 -2.238470331167361e-09 2.320699803182652e-08 ] [ 3.226592430424443e-08 -7.447524959505993e-09 1.980442510087776e-09 ] [ 1.570238062996195e-08 1.255558830716444e-08 -1.747155228016559e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -0.041588368 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.663191090682686e-21 } "relaxed-configuration-positions" { "source-value" [ [ 0.8269899 0.3352181 0.4433252 ] [ 0.3116105 -0.040025 2.6947653 ] [ 0.8897993 2.7560399 0.9380024 ] [ 0.3708478 2.2437174 3.1614291 ] [ 3.1377931 0.4199441 0.0849703 ] [ 3.1970464 2.7036913 0.5516299 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.269899e-11 3.352181e-11 4.433252e-11 ] [ 3.116105e-11 -4.0025e-12 2.6947653e-10 ] [ 8.897993e-11 2.756039900000001e-10 9.380024000000001e-11 ] [ 3.708478e-11 2.2437174e-10 3.1614291e-10 ] [ 3.1377931e-10 4.199441e-11 8.49703e-12 ] [ 3.1970464e-10 2.7036913e-10 5.516299e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.19e-05 1.38e-05 1.6e-06 ] [ -4.9e-06 1.02e-05 6.3e-06 ] [ 3.4e-06 -6.7e-06 -6.8e-06 ] [ 7.3e-06 -1.24e-05 -5.8e-06 ] [ -1.6e-06 4.95e-05 8.3e-06 ] [ -1.62e-05 -5.44e-05 -3.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.906590178752e-14 2.211003736704e-14 2.56348259328e-15 ] [ -7.850665441919999e-15 1.634220153216e-14 1.009371271104e-14 ] [ 5.44740051072e-15 -1.073458335936e-14 -1.089480102144e-14 ] [ 1.169588933184e-14 -1.986699009792e-14 -9.292624400640001e-15 ] [ -2.56348259328e-15 7.930774272959999e-14 1.329806595264e-14 ] [ -2.595526125696e-14 -8.715840817152e-14 -5.928053496960001e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.418059 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.470245366791503e-18 } }