{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.8670835 0.0748596 0.0624467 ] [ 1.077368 0.92169 1.864842 ] [ 2.976718 2.979813 0.7013645 ] [ 1.541867 2.360612 1.695051 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.670835000000001e-11 7.48596e-12 6.24467e-12 ] [ 1.077368e-10 9.216900000000001e-11 1.864842e-10 ] [ 2.976718e-10 2.979813e-10 7.013645e-11 ] [ 1.541867e-10 2.360612e-10 1.695051e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.462407 -1.6861372 -4.0370252 ] [ -12.2613421 -39.5112537 8.7912779 ] [ 8.4050354 3.076106 -5.7981534 ] [ 4.3187138 38.1212848 1.0439007 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.40857690798038e-10 -2.701489623558184e-09 -6.468027446309177e-09 ] [ -1.964483581410049e-08 -6.330400745818604e-08 1.408518003438059e-08 ] [ 1.346635132582284e-08 4.928465156907204e-09 -9.289665897827653e-09 ] [ 6.919342339293349e-09 6.107703176461936e-08 1.672513309756244e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 3.4919091 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.594655168071969e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.6711415 0.43551 0.0525181 ] [ 1.1697037 0.3724248 2.3466416 ] [ 3.3889229 3.104808 0.7373991 ] [ 1.2332684 2.4242317 1.1871453 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.711414999999999e-11 4.3551e-11 5.25181e-12 ] [ 1.1697037e-10 3.724248e-11 2.3466416e-10 ] [ 3.3889229e-10 3.104808e-10 7.373991e-11 ] [ 1.2332684e-10 2.4242317e-10 1.1871453e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.2e-06 -2e-06 -6.5e-06 ] [ 2.8e-06 0.0 2.9e-06 ] [ 7e-06 -4.8e-06 -3.8e-06 ] [ -1.4e-05 6.8e-06 7.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.729141862799999e-15 -3.204353268e-15 -1.0414148121e-14 ] [ 4.486094575199999e-15 0.0 4.6463122386e-15 ] [ 1.1215236438e-14 -7.690447843199998e-15 -6.088271209199999e-15 ] [ -2.243047287599999e-14 1.08948011112e-14 1.18561070916e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.4672565 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.356604051838462e-18 } }