{ "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" [ [ 1.239329 2.983674 3.512225 ] [ 2.999663 5.449943 1.062375 ] [ 1.178907 3.936124 1.554887 ] [ 2.122325 5.087093 3.38156 ] [ 3.136296 3.082629 1.288456 ] [ 5.117946 4.70791 1.219676 ] [ 3.839933 3.58316 3.463374 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.239329e-10 2.983674e-10 3.512225e-10 ] [ 2.999663e-10 5.449943e-10 1.062375e-10 ] [ 1.178907e-10 3.936124e-10 1.554887e-10 ] [ 2.122325e-10 5.087093000000001e-10 3.38156e-10 ] [ 3.136296e-10 3.082629e-10 1.288456e-10 ] [ 5.117946e-10 4.70791e-10 1.219676e-10 ] [ 3.839933e-10 3.58316e-10 3.463374e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.7711973 -5.3614887 5.258394 ] [ -1.5681563 7.2157984 -2.5894084 ] [ -8.1504866 -0.8500693 -7.7617556 ] [ 1.8182903 7.243095 5.7829543 ] [ 3.8139068 -7.4745173 -3.5101648 ] [ 4.5679546 0.5152026 -1.0536391 ] [ 5.2896885 -1.2880206 3.8736196 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.246477464263887e-09 -8.590051918595035e-09 8.424875999165794e-09 ] [ -2.512463382319894e-09 1.156098359213458e-08 -4.148689634363325e-09 ] [ -1.30585191862501e-08 -1.361961169740736e-09 -1.243570346113865e-08 ] [ 2.91322223248885e-09 1.160471756684223e-08 9.265314254949826e-09 ] [ 6.110552359213711e-09 -1.197549696848877e-08 -5.623904024049283e-09 ] [ 7.318670125292817e-09 8.254455674960482e-10 -1.688115946688789e-09 ] [ 8.475015315838508e-09 -2.06363650943066e-09 6.206222812124426e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.3284295 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.49457917768163e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8789863 3.3823687 3.4741617 ] [ 2.5104275 5.8007238 1.3689905 ] [ 1.4091056 3.5927325 1.027925 ] [ 2.5247157 5.3362767 3.7462576 ] [ 3.5853933 2.5588225 1.2771769 ] [ 4.7936639 4.8119485 1.0247438 ] [ 3.9321066 3.3476604 3.5632976 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.789863e-11 3.3823687e-10 3.4741617e-10 ] [ 2.5104275e-10 5.8007238e-10 1.3689905e-10 ] [ 1.4091056e-10 3.5927325e-10 1.027925e-10 ] [ 2.5247157e-10 5.3362767e-10 3.7462576e-10 ] [ 3.5853933e-10 2.5588225e-10 1.2771769e-10 ] [ 4.7936639e-10 4.8119485e-10 1.0247438e-10 ] [ 3.9321066e-10 3.3476604e-10 3.5632976e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.78e-05 -7.2e-06 -2.8e-06 ] [ -8.8e-06 -1.12e-05 -8.4e-06 ] [ 1.8e-06 -6.8e-06 9e-07 ] [ 1.8e-05 2.35e-05 1.6e-06 ] [ 4.3e-06 3.4e-05 1.48e-05 ] [ -1.7e-06 -1.1e-06 4e-07 ] [ -3.14e-05 -3.12e-05 -6.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.851874408519999e-14 -1.15356717648e-14 -4.486094575199999e-15 ] [ -1.40991543792e-14 -1.79443783008e-14 -1.34582837256e-14 ] [ 2.8839179412e-15 -1.08948011112e-14 1.4419589706e-15 ] [ 2.8839179412e-14 3.765115089899999e-14 2.5634826144e-15 ] [ 6.8893595262e-15 5.447400555599999e-14 2.37122141832e-14 ] [ -2.7237002778e-15 -1.7623942974e-15 6.408706536e-16 ] [ -5.030834630759999e-14 -4.998791098079999e-14 -1.05743657844e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.714404 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.998378080803613e-18 } }