{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 7.668168e-11 2.5044199e-10 2.0902674e-10 ] [ 2.1423667e-10 6.292671e-11 1.6849739e-10 ] [ 2.8525451e-10 2.7794263e-10 1.0183277e-10 ] ] "source-value" [ [ 0.7668168 2.5044199 2.0902674 ] [ 2.1423667 0.6292671 1.6849739 ] [ 2.8525451 2.7794263 1.0183277 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 8.2327845659808e-12 1.5108525534144e-13 -4.09404191913024e-12 ] [ -9.25256998512e-13 -5.68772700384e-14 4.6591296132864e-13 ] [ -7.3075275674688e-12 -9.420798530304e-14 3.6281289578016e-12 ] ] "source-value" [ [ 0.0051385 9.43e-05 -0.0025553 ] [ -0.0005775 -3.55e-05 0.0002908 ] [ -0.004561 -5.88e-05 0.0022645 ] ] } "species" { "source-value" [ "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.085610765495937e-18 "source-value" -6.7758495 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -2.698661439130138e-10 -5.467020765618317e-10 2.136677161088467e-10 ] [ -3.936915176187088e-09 -1.084843691395197e-08 3.538479966073047e-09 ] [ 4.206781320100102e-09 1.13951389905138e-08 -3.752147682181893e-09 ] ] "source-value" [ [ -0.1684372 -0.3412246 0.1333609 ] [ -2.4572292 -6.7710618 2.2085455 ] [ 2.6256664 7.1122864 -2.3419064 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -9.242325026935956e-19 "source-value" -5.7686056 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 7.252086e-11 2.552897e-10 2.103736e-10 ] [ 2.233995e-10 7.543773000000001e-11 1.621303e-10 ] [ 2.802525e-10 2.605839e-10 1.06853e-10 ] ] "source-value" [ [ 0.7252086 2.552897 2.103736 ] [ 2.233995 0.7543773 1.621303 ] [ 2.802525 2.605839 1.06853 ] ] } "instance-id" 1 }