{ "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" [ [ 2.975716 3.919 3.294603 ] [ 5.229011 2.380728 1.260294 ] [ 3.72512 0.5184044 0.8589665 ] [ 3.15133 1.64182 3.064405 ] [ 5.039876 3.004083 3.766304 ] [ 5.090657 4.730463 1.850516 ] [ 3.207695 3.468122 0.7711985 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.975716e-10 3.919e-10 3.294603e-10 ] [ 5.229011e-10 2.380728e-10 1.260294e-10 ] [ 3.72512e-10 5.184044e-11 8.589665e-11 ] [ 3.151330000000001e-10 1.64182e-10 3.064405e-10 ] [ 5.039876e-10 3.004083e-10 3.766304e-10 ] [ 5.090657000000001e-10 4.730463000000001e-10 1.850516e-10 ] [ 3.207695e-10 3.468122e-10 7.711985e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 5.902861 -3.717814 -5.4438109 ] [ -7.8939343 2.8972699 4.9648845 ] [ 1.3045039 6.6907042 4.0996482 ] [ 5.5235214 5.0749447 -5.0002943 ] [ -5.4461878 0.3917243 -8.4064776 ] [ -5.3277456 -9.2942866 1.8342842 ] [ 5.9369814 -2.0425426 7.951766 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.457425890032108e-09 -5.956594671282931e-09 -8.721946552036207e-09 ] [ -1.264747698159121e-08 4.641938097927553e-09 7.954621870872298e-09 ] [ 2.090045650322421e-09 1.071968984592837e-08 6.568360499544802e-09 ] [ 8.849656851568485e-09 8.13095775019287e-09 -8.011354624579502e-09 ] [ -8.725754765646184e-09 6.276115152592455e-10 -1.34686618739989e-08 ] [ -8.535989441890068e-09 -1.489108869753472e-08 2.938847261142831e-09 ] [ 9.512092797204451e-09 -3.272514000708046e-09 1.274013357927233e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -33.962191 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.441342841134417e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.0642485 3.9643896 3.1006212 ] [ 5.2090575 2.2643392 1.5940732 ] [ 3.6067582 0.9756252 0.7808656 ] [ 3.4244316 1.8059075 2.8221559 ] [ 5.0242632 3.0916668 3.6306608 ] [ 4.8454136 4.4219324 1.874909 ] [ 3.2452323 3.1387596 1.0630014 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0642485e-10 3.9643896e-10 3.1006212e-10 ] [ 5.2090575e-10 2.2643392e-10 1.5940732e-10 ] [ 3.6067582e-10 9.756252e-11 7.808656e-11 ] [ 3.4244316e-10 1.8059075e-10 2.8221559e-10 ] [ 5.0242632e-10 3.0916668e-10 3.6306608e-10 ] [ 4.8454136e-10 4.421932400000001e-10 1.874909e-10 ] [ 3.2452323e-10 3.138759600000001e-10 1.0630014e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.5e-06 -4.4e-06 -0.0001104 ] [ -9.44e-05 9.97e-05 -9.23e-05 ] [ -4.36e-05 -1.07e-05 0.0001781 ] [ 2.52e-05 -3.96e-05 -8.71e-05 ] [ 5.5e-05 -4.2e-05 2.47e-05 ] [ -3.11e-05 -9.7e-06 0.0001112 ] [ 9.53e-05 6.6e-06 -2.42e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.04141480352e-14 -7.04957713152e-15 -1.7688029893632e-13 ] [ -1.5124547300352e-13 1.5973700909376e-13 -1.4788090209984e-13 ] [ -6.985490066688e-14 -1.714328984256e-14 2.8534765616448e-13 ] [ 4.037485084416e-14 -6.344619418368e-14 -1.3954958367168e-13 ] [ 8.8119714144e-14 -6.72914180736e-14 3.957376253376001e-14 ] [ -4.982769290688e-14 -1.554111322176e-14 1.7816204023296e-13 ] [ 1.5268743196224e-13 1.057436569728e-14 -3.877267422336e-14 ] ] } "relaxed-potential-energy" { "source-value" -50.517683 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.093825063958561e-18 } }