{ "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" [ [ 0.09862 0.3102875 1.608695 ] [ 0.216089 2.435481 0.8089597 ] [ 1.587261 0.9923217 0.3598848 ] [ 2.442881 2.780277 0.9615339 ] [ 1.769015 1.574471 2.844855 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.862e-12 3.102875e-11 1.608695e-10 ] [ 2.16089e-11 2.435481e-10 8.089597e-11 ] [ 1.587261e-10 9.923217e-11 3.598848e-11 ] [ 2.442881e-10 2.780277e-10 9.615339e-11 ] [ 1.769015e-10 1.574471e-10 2.844855e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.4138643 -8.4008081 5.4019363 ] [ -12.226032 10.8815836 -2.1384137 ] [ 8.0530305 -11.1036717 -12.1385279 ] [ 9.1837038 9.0209881 0.3629547 ] [ 2.4031619 -0.3980918 8.5120506 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.187832005124376e-08 -1.345957833364727e-08 8.654856046910854e-09 ] [ -1.958826263555267e-08 1.74342188412007e-08 -3.426116435738425e-09 ] [ 1.290237719368933e-08 -1.779004320277859e-08 -1.944806561230852e-08 ] [ 1.471391552071212e-08 1.445321623033501e-08 5.815175347494779e-10 ] [ 3.850289812177307e-09 -6.378133748921894e-10 1.363780846638661e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -4.6071411 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.381453759146795e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.1855082 0.4367177 1.8515595 ] [ -0.0240583 2.5851573 0.5339824 ] [ 1.6787835 0.7761119 -0.1610468 ] [ 2.4072753 2.777301 1.2028644 ] [ 1.8663573 1.5175503 3.1565689 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.855082e-11 4.367177e-11 1.8515595e-10 ] [ -2.40583e-12 2.5851573e-10 5.339824e-11 ] [ 1.6787835e-10 7.761118999999999e-11 -1.610468e-11 ] [ 2.4072753e-10 2.777301e-10 1.2028644e-10 ] [ 1.8663573e-10 1.5175503e-10 3.1565689e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.56e-05 -9.5e-06 1.07e-05 ] [ -8.8e-06 1.98e-05 8.5e-06 ] [ 4.14e-05 -1e-05 -3.21e-05 ] [ -2e-05 -1.31e-05 -1.5e-06 ] [ 2.29e-05 1.28e-05 1.44e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.703748770048e-14 -1.52206778976e-14 1.714328984256e-14 ] [ -1.409915426304e-14 3.172309709184e-14 1.36185012768e-14 ] [ 6.633011210111999e-14 -1.6021766208e-14 -5.142986952768e-14 ] [ -3.2043532416e-14 -2.098851373248e-14 -2.4032649312e-15 ] [ 3.668984461632e-14 2.050786074624e-14 2.307134333952e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.878088 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.903079489340503e-18 } }