{ "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" [ [ 2.072399 2.177963 4.557602 ] [ 2.377271 3.879759 3.040396 ] [ 5.261436 0.7705425 2.642102 ] [ 4.650297 3.074511 2.607434 ] [ 3.240336 1.703827 1.872622 ] [ 3.483569 0.4560924 3.818111 ] [ 3.60342 3.885532 5.130911 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.072399e-10 2.177963e-10 4.557602e-10 ] [ 2.377271e-10 3.879759e-10 3.040396e-10 ] [ 5.261436e-10 7.705425e-11 2.642102e-10 ] [ 4.650297000000001e-10 3.074511e-10 2.607434e-10 ] [ 3.240336e-10 1.703827e-10 1.872622e-10 ] [ 3.483569e-10 4.560924000000001e-11 3.818111e-10 ] [ 3.60342e-10 3.885532e-10 5.130911000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.0441547 -7.7432639 4.6802989 ] [ -4.3107672 4.6337213 -9.5303662 ] [ 23.5233026 -7.6185162 -5.1344121 ] [ 18.1235701 21.7955488 5.5597622 ] [ -24.9869646 -5.8025224 -16.0635584 ] [ -12.4632978 -9.7009332 14.0661531 ] [ 6.1583116 4.4359656 6.4221225 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.68380343262128e-09 -1.240607649147571e-08 7.498665537715903e-09 ] [ -6.906610482453604e-09 7.424039995328103e-09 -1.526933003910337e-08 ] [ 3.768848578023145e-08 -1.220620864139047e-08 -8.22623509594687e-09 ] [ 2.903716053888104e-08 3.492031901256674e-08 8.907721087436433e-09 ] [ -4.003353083670515e-08 -9.2966658075416e-09 -2.573665792737443e-08 ] [ -1.99684045177436e-08 -1.554260850103485e-08 2.253646182708666e-08 ] [ 9.866702950411154e-09 7.10720043354779e-09 1.028937461018566e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -9.9733557 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.597907746511071e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0798365 2.1077106 4.9917431 ] [ 2.188425 3.6576236 2.8845658 ] [ 5.3919637 0.9356854 2.9402457 ] [ 4.92472 3.4553596 2.6603606 ] [ 3.153658 1.6791579 1.5259046 ] [ 3.0166501 0.1875854 3.6731464 ] [ 3.9334748 3.9251044 4.9932119 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0798365e-10 2.1077106e-10 4.9917431e-10 ] [ 2.188425e-10 3.6576236e-10 2.8845658e-10 ] [ 5.3919637e-10 9.356854e-11 2.9402457e-10 ] [ 4.92472e-10 3.4553596e-10 2.6603606e-10 ] [ 3.153658e-10 1.6791579e-10 1.5259046e-10 ] [ 3.0166501e-10 1.875854e-11 3.6731464e-10 ] [ 3.9334748e-10 3.9251044e-10 4.9932119e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.55e-05 1.5e-06 -3.3e-06 ] [ -4.4e-06 -2.16e-05 -2.2e-06 ] [ -1.59e-05 -1e-07 6.9e-06 ] [ 6e-07 -1.6e-06 1e-05 ] [ 2.6e-06 1.76e-05 -7e-06 ] [ -1.5e-06 -3e-07 2.3e-06 ] [ 3e-06 4.4e-06 -6.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.4833737827e-14 2.403264951e-15 -5.2871828922e-15 ] [ -7.0495771896e-15 -3.46070152944e-14 -3.5247885948e-15 ] [ -2.54746084806e-14 -1.602176634e-16 1.10550187746e-14 ] [ 9.613059803999998e-16 -2.5634826144e-15 1.602176634e-14 ] [ 4.165659248399999e-15 2.81983087584e-14 -1.1215236438e-14 ] [ -2.403264951e-15 -4.806529901999999e-16 3.685006258199999e-15 ] [ 4.806529901999999e-15 7.0495771896e-15 -1.05743657844e-14 ] ] } "relaxed-potential-energy" { "source-value" -23.737843 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.803221739616046e-18 } }