{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.625679 2.727046 1.588106 ] [ 1.116882 2.069952 3.236218 ] [ 3.070568 3.395161 4.858531 ] [ 1.593326 4.342716 3.66284 ] [ 4.916804 2.207526 1.823276 ] [ 3.525085 1.533636 3.413768 ] [ 3.625469 4.392152 2.422621 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.625679e-10 2.727046e-10 1.588106e-10 ] [ 1.116882e-10 2.069952e-10 3.236218e-10 ] [ 3.070568e-10 3.395161e-10 4.858531e-10 ] [ 1.593326e-10 4.342716e-10 3.66284e-10 ] [ 4.916804e-10 2.207526e-10 1.823276e-10 ] [ 3.525085e-10 1.533636e-10 3.413768e-10 ] [ 3.625469e-10 4.392152e-10 2.422621e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0613574 -1.5592119 -2.6373602 ] [ -0.9580201 -0.8911849 -0.6347875 ] [ 2.9106364 -0.2324724 1.6159503 ] [ -1.7192575 1.2583586 -0.5263589 ] [ 0.8398208 0.5917915 -0.5125911 ] [ -1.0420497 -1.8786679 2.1152883 ] [ 1.0302276 2.711387 0.5798591 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.700482026602991e-09 -2.498132873634744e-09 -4.225516887881566e-09 ] [ -1.534917419122343e-09 -1.427835623353626e-09 -1.017041700055275e-09 ] [ 4.663353630149877e-09 -3.724618473299016e-10 2.58903781236529e-09 ] [ -2.754554194329255e-09 2.016112746112952e-09 -8.433199306779425e-10 ] [ 1.345541262507187e-09 9.48154513499811e-10 -8.212614832163573e-10 ] [ -1.669547680806709e-09 -3.009957812425848e-09 3.389065488433582e-09 ] [ 1.650606588421898e-09 4.344120897131359e-09 9.290367010322693e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -18.284216005765543 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.929454365544636e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4927014 2.8368663 1.0495261 ] [ 1.3845953 2.0400393 2.8952971 ] [ 3.5811092 3.5571053 4.7927962 ] [ 1.5211633 4.1638943 3.7557126 ] [ 4.5526417 2.2300677 2.0866117 ] [ 3.3611172 1.4578209 3.8903912 ] [ 3.5804849 4.3823953 2.5350251 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4927014e-10 2.8368663e-10 1.0495261e-10 ] [ 1.3845953e-10 2.0400393e-10 2.8952971e-10 ] [ 3.5811092e-10 3.5571053e-10 4.7927962e-10 ] [ 1.5211633e-10 4.1638943e-10 3.7557126e-10 ] [ 4.5526417e-10 2.2300677e-10 2.0866117e-10 ] [ 3.3611172e-10 1.4578209e-10 3.8903912e-10 ] [ 3.5804849e-10 4.3823953e-10 2.5350251e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.56e-05 1.9e-06 -2.87e-05 ] [ 6.1e-06 2.92e-05 2.89e-05 ] [ -2.05e-05 -3.32e-05 2.23e-05 ] [ -1.89e-05 -1.47e-05 1.38e-05 ] [ -1.47e-05 1.3e-05 -2e-06 ] [ 1.53e-05 3.08e-05 3e-06 ] [ 1.73e-05 -2.72e-05 -3.72e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.49939554904e-14 3.0441356046e-15 -4.598246939579999e-14 ] [ 9.773277467399999e-15 4.67835577128e-14 4.63029047226e-14 ] [ -3.2844620997e-14 -5.31922642488e-14 3.572853893819999e-14 ] [ -3.02811383826e-14 -2.35519965198e-14 2.21100375492e-14 ] [ -2.35519965198e-14 2.082829624199999e-14 -3.204353268e-15 ] [ 2.45133025002e-14 4.93470403272e-14 4.806529901999999e-15 ] [ 2.77176557682e-14 -4.35792044448e-14 -5.96009707848e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.808943005765546 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.333960226207528e-18 } }