{ "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" [ [ 0.4009464 1.193297 0.9558509 ] [ 0.2244953 2.906435 0.4394059 ] [ 0.3187826 2.815079 2.795658 ] [ 1.502588 0.0124763 2.860219 ] [ 2.103704 2.743898 0.1444875 ] [ 2.704733 1.991532 2.940817 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.009464e-11 1.193297e-10 9.558509e-11 ] [ 2.244953e-11 2.906435e-10 4.394059e-11 ] [ 3.187826e-11 2.815079e-10 2.795658e-10 ] [ 1.502588e-10 1.24763e-12 2.860219e-10 ] [ 2.103704e-10 2.743898e-10 1.444875e-11 ] [ 2.704733e-10 1.991532e-10 2.940817e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.7540523 -31.7213043 -3.7959221 ] [ -13.8129278 19.2131927 -8.541389 ] [ -7.4087787 11.3356494 17.6719908 ] [ 2.4116665 -7.1588597 1.5195027 ] [ 23.5580459 5.6412274 -11.5630189 ] [ 7.0060464 2.6900945 4.7088365 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.883206779472046e-08 -5.082313213074251e-08 -6.08173764299804e-09 ] [ -2.213074998595838e-08 3.078292815486523e-08 -1.368481376495829e-08 ] [ -1.187017202182102e-08 1.816171245026554e-08 2.831365050275269e-08 ] [ 3.863915683466563e-09 -1.14697576429273e-08 2.434511701182476e-09 ] [ 3.77441503727133e-08 9.03824265289637e-09 -1.852599854744853e-08 ] [ 1.122492374632001e-08 4.310006515642665e-09 7.5443877514697e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 8.049074 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.289603818188914e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.0828765 0.4362941 0.8776849 ] [ 0.1176852 2.7957559 0.5660865 ] [ 0.3959881 3.3959114 2.975312 ] [ 1.6461491 -0.0056534 2.470225 ] [ 2.6109562 2.8707976 0.4247696 ] [ 2.5673472 2.1696117 2.8223603 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -8.28765e-12 4.362941e-11 8.776849e-11 ] [ 1.176852e-11 2.7957559e-10 5.660865000000001e-11 ] [ 3.959881e-11 3.3959114e-10 2.975312e-10 ] [ 1.6461491e-10 -5.653400000000001e-13 2.470225e-10 ] [ 2.6109562e-10 2.8707976e-10 4.247696e-11 ] [ 2.5673472e-10 2.1696117e-10 2.8223603e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.44e-05 -7.3e-06 1.98e-05 ] [ -1.95e-05 -5.5e-06 -1.41e-05 ] [ 6.6e-06 1.41e-05 -7e-06 ] [ -9.6e-06 1.1e-05 -2.31e-05 ] [ 7e-07 9e-06 6.9e-06 ] [ 7.4e-06 -2.14e-05 1.74e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.307134333952e-14 -1.169588933184e-14 3.172309709184e-14 ] [ -3.12424441056e-14 -8.8119714144e-15 -2.259069035328e-14 ] [ 1.057436569728e-14 2.259069035328e-14 -1.12152363456e-14 ] [ -1.538089555968e-14 1.76239428288e-14 -3.701027994048e-14 ] [ 1.12152363456e-15 1.44195895872e-14 1.105501868352e-14 ] [ 1.185610699392e-14 -3.428657968511999e-14 2.787787320192e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.132746 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.104097860810472e-18 } }