{ "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" [ [ -4.4923483 -48.9690087 4.4538286 ] [ -21.8101664 39.5900762 -4.7350154 ] [ -1.1110286 6.9324617 3.9176233 ] [ 0.4372588 -4.0168064 1.8278528 ] [ 25.0601435 3.666714 -5.9635598 ] [ 1.9161409 2.7965632 0.4992704 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.197535418750625e-09 -7.845700088289181e-08 7.135820055970395e-09 ] [ -3.49437387018377e-08 6.34302945033305e-08 -7.58633097300796e-09 ] [ -1.780064047960155e-09 1.110702806033142e-08 6.276724460361344e-09 ] [ 7.005658265990631e-10 -6.435633304359814e-09 2.928543022423818e-09 ] [ 4.015077602959308e-08 5.874723445960051e-09 -9.554676088302724e-09 ] [ 3.069996152138671e-09 4.480588177629635e-09 7.999193623374644e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 0.93409364 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.496582991645972e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.1508869 0.3659847 0.8194988 ] [ 0.179909 2.819448 0.6014675 ] [ 0.326075 3.4480402 3.0405774 ] [ 1.6877486 -0.0943903 2.5337409 ] [ 2.6899328 2.8907373 0.3555707 ] [ 2.5224709 2.2328974 2.7855829 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.508869e-11 3.659847e-11 8.194988e-11 ] [ 1.79909e-11 2.819448e-10 6.014675e-11 ] [ 3.26075e-11 3.4480402e-10 3.0405774e-10 ] [ 1.6877486e-10 -9.43903e-12 2.5337409e-10 ] [ 2.6899328e-10 2.8907373e-10 3.555707000000001e-11 ] [ 2.5224709e-10 2.2328974e-10 2.7855829e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8e-07 -2.57e-05 -7.5e-06 ] [ 1.75e-05 1.53e-05 2e-07 ] [ -1.92e-05 1.58e-05 2.39e-05 ] [ -6.2e-06 -5.4e-06 6.2e-06 ] [ 1e-07 1.2e-06 -1.4e-05 ] [ 8.5e-06 -1.2e-06 -8.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.28174129664e-15 -4.117593915456e-14 -1.2016324656e-14 ] [ 2.8038090864e-14 2.451330229824e-14 3.2043532416e-16 ] [ -3.076179111936e-14 2.531439060864e-14 3.829202123712e-14 ] [ -9.93349504896e-15 -8.65175375232e-15 9.93349504896e-15 ] [ 1.6021766208e-16 1.92261194496e-15 -2.24304726912e-14 ] [ 1.36185012768e-14 -1.92261194496e-15 -1.409915426304e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.273917 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.767586596703968e-18 } }