{ "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" [ [ 1.43906 1.00085 1.609326 ] [ 1.205531 2.018769 3.811036 ] [ 1.566383 3.683465 1.956037 ] [ 3.913976 1.646449 1.998722 ] [ 3.334697 0.9502568 4.182978 ] [ 3.589337 3.768444 1.401362 ] [ 3.236168 3.404887 3.941176 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.43906e-10 1.00085e-10 1.609326e-10 ] [ 1.205531e-10 2.018769e-10 3.811036e-10 ] [ 1.566383e-10 3.683465e-10 1.956037e-10 ] [ 3.913976e-10 1.646449e-10 1.998722e-10 ] [ 3.334697e-10 9.502568000000001e-11 4.182978000000001e-10 ] [ 3.589337e-10 3.768444e-10 1.401362e-10 ] [ 3.236168e-10 3.404887e-10 3.941176e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5771183 -1.2220263 0.3912322 ] [ -1.7422417 0.0500358 0.9487697 ] [ -5.0777154 -1.1147385 1.116938 ] [ 0.5099522 -2.0621514 -0.9152608 ] [ -0.1292292 -1.0119988 0.9317706 ] [ 6.3858694 4.7329077 -1.5996964 ] [ 0.630483 0.6279716 -0.8737533 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.246454553138021e-10 -1.957901983993474e-09 6.268230893084147e-10 ] [ -2.791378942520438e-09 8.016618962349719e-11 1.52009664438719e-09 ] [ -8.135396967981962e-09 -1.786007977720209e-09 1.789531965226692e-09 ] [ 8.170334992968947e-10 -3.303930788850387e-09 -1.466409467776147e-09 ] [ -2.070480046705128e-10 -1.621400830996039e-09 1.49286108356816e-09 ] [ 1.02312907404556e-08 7.582954127818682e-09 -2.562996193573918e-09 ] [ 1.010145130734222e-09 1.006121424335594e-09 -1.399907121140392e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.048417 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.051892863208838e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5162982 0.7751415 2.0354546 ] [ 1.0483157 2.2506144 3.99512 ] [ 1.6191164 3.2727336 1.7706912 ] [ 3.8045979 1.7707454 1.7336495 ] [ 3.1061943 0.8363191 3.9602435 ] [ 3.8830324 4.2298584 1.5906697 ] [ 3.3075971 3.3377084 3.8148085 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5162982e-10 7.751415e-11 2.0354546e-10 ] [ 1.0483157e-10 2.2506144e-10 3.99512e-10 ] [ 1.6191164e-10 3.2727336e-10 1.7706912e-10 ] [ 3.8045979e-10 1.7707454e-10 1.7336495e-10 ] [ 3.1061943e-10 8.363191e-11 3.9602435e-10 ] [ 3.8830324e-10 4.2298584e-10 1.5906697e-10 ] [ 3.307597100000001e-10 3.3377084e-10 3.8148085e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.11e-05 -1.64e-05 -2.5e-06 ] [ -1.75e-05 0.0 2.77e-05 ] [ -1.7e-06 -1.74e-05 -2.75e-05 ] [ -1.24e-05 2.31e-05 -1.13e-05 ] [ 8.1e-06 1.86e-05 2e-07 ] [ 2.24e-05 6e-07 2.55e-05 ] [ 1.22e-05 -8.6e-06 -1.22e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.77841606374e-14 -2.62756967976e-14 -4.005441585e-15 ] [ -2.8038091095e-14 0.0 4.438029276179999e-14 ] [ -2.7237002778e-15 -2.78778734316e-14 -4.4059857435e-14 ] [ -1.98669902616e-14 3.70102802454e-14 -1.81045959642e-14 ] [ 1.29776307354e-14 2.98004853924e-14 3.204353268e-16 ] [ 3.588875660159999e-14 9.613059803999998e-16 4.0855504167e-14 ] [ 1.95465549348e-14 -1.37787190524e-14 -1.95465549348e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.073267 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.536527262344328e-18 } }