{ "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" [ [ 1.593193 1.569284 2.84459 ] [ 1.603337 4.216737 3.188357 ] [ 3.675145 1.205287 1.773064 ] [ 3.545696 2.526378 4.008338 ] [ 3.206595 3.44318 2.117333 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.593193e-10 1.569284e-10 2.84459e-10 ] [ 1.603337e-10 4.216737e-10 3.188357e-10 ] [ 3.675145e-10 1.205287e-10 1.773064e-10 ] [ 3.545696e-10 2.526378e-10 4.008338e-10 ] [ 3.206595e-10 3.44318e-10 2.117333e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.8763986 -1.3750386 1.1130961 ] [ -3.2604859 0.7142502 1.7703433 ] [ 2.6745617 -4.913253 -3.6558369 ] [ 2.037915 -0.0274646 6.6104668 ] [ 3.4244079 5.601506 -5.8380693 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.81285189499031e-09 -2.203054715768073e-09 1.783376562816527e-09 ] [ -5.22387432446646e-09 1.144354981269827e-09 2.836402669418452e-09 ] [ 4.285120261931317e-09 -7.871899153530401e-09 -5.857296458894994e-09 ] [ 3.265099795078109e-09 -4.400314038215639e-11 1.059113544679275e-08 ] [ 5.486506322665008e-09 8.974602028410802e-09 -9.353618220132735e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.239666 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.121228350716424e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4966661 1.7675029 2.6131228 ] [ 1.5763503 4.1342748 3.5874632 ] [ 3.8733013 1.0501205 1.9852231 ] [ 3.5024457 2.5127181 4.0541231 ] [ 3.1752026 3.4962497 1.6917497 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4966661e-10 1.7675029e-10 2.6131228e-10 ] [ 1.5763503e-10 4.1342748e-10 3.5874632e-10 ] [ 3.8733013e-10 1.0501205e-10 1.9852231e-10 ] [ 3.5024457e-10 2.5127181e-10 4.0541231e-10 ] [ 3.1752026e-10 3.4962497e-10 1.6917497e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.03e-05 0.0001129 3.68e-05 ] [ 5.9e-06 -0.000228 -0.0001608 ] [ -9.25e-05 -0.0001885 -1.63e-05 ] [ 5.62e-05 0.0001351 -6.31e-05 ] [ -2e-05 0.0001685 0.0002033 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.05894846902e-14 1.808857419786e-13 5.896010013119999e-14 ] [ 9.452842140600001e-15 -3.65296272552e-13 -2.576300027472e-13 ] [ -1.48201338645e-13 -3.020102955089999e-13 -2.61154791342e-14 ] [ 9.004232683079999e-14 2.164540632534e-13 -1.010973456054e-13 ] [ -3.204353268e-14 2.699667628289999e-13 3.257225096922e-13 ] ] } "relaxed-potential-energy" { "source-value" -16.118168 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.582415215248651e-18 } }