{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.5419945 1.059703 1.497036 ] [ 0.5287309 2.297187 0.1799033 ] [ 1.173246 2.181689 2.79912 ] [ 2.288869 1.000101 0.1162968 ] [ 2.25753 0.9328521 1.885741 ] [ 2.965412 2.910996 0.3877363 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.419945000000001e-11 1.059703e-10 1.497036e-10 ] [ 5.287309e-11 2.297187e-10 1.799033e-11 ] [ 1.173246e-10 2.181689e-10 2.79912e-10 ] [ 2.288869e-10 1.000101e-10 1.162968e-11 ] [ 2.25753e-10 9.328521e-11 1.885741e-10 ] [ 2.965412e-10 2.910996e-10 3.877363e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -31.2720086 -19.3652467 1.9236573 ] [ -10.6775573 17.1463013 -17.3312236 ] [ -2.6316095 18.5771899 20.5617622 ] [ 9.2717318 -10.4857302 -26.2736092 ] [ 29.3841644 -16.3485188 22.3339123 ] [ 5.9252791 10.4760046 -1.214499 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.010328106437654e-08 -3.102654551876435e-08 3.082038752491252e-09 ] [ -1.710733267331237e-08 2.747140307605265e-08 -2.776768126177721e-08 ] [ -4.216303215975178e-09 2.976393933794189e-08 3.294357467928917e-08 ] [ 1.48549519242879e-08 -1.679999177845651e-08 -4.209496240427579e-08 ] [ 4.707862122342366e-08 -2.619321460606927e-08 3.578287213805756e-08 ] [ 9.493343645734865e-09 1.678440964951326e-08 -1.945841903784979e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 7.1600889 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.147172703842959e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3096422 0.5374632 1.4916048 ] [ 0.485545 2.6896303 0.1167664 ] [ 1.1327953 2.6964627 2.5934484 ] [ 2.1191309 0.7643832 -0.3048402 ] [ 2.7663824 0.7712103 2.1718434 ] [ 2.9422867 2.9233785 0.7970107 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.096422e-11 5.374632e-11 1.4916048e-10 ] [ 4.85545e-11 2.6896303e-10 1.167664e-11 ] [ 1.1327953e-10 2.6964627e-10 2.5934484e-10 ] [ 2.1191309e-10 7.643832000000001e-11 -3.048402e-11 ] [ 2.7663824e-10 7.712103e-11 2.1718434e-10 ] [ 2.9422867e-10 2.9233785e-10 7.970107e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.5e-06 -8.5e-06 -2.46e-05 ] [ 4.1e-06 -1.6e-06 2e-06 ] [ 1.47e-05 5.5e-06 1.27e-05 ] [ -1.34e-05 -1.96e-05 9e-06 ] [ -9.1e-06 7.9e-06 -8e-07 ] [ -1.8e-06 1.63e-05 1.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.8119714144e-15 -1.36185012768e-14 -3.941354487168e-14 ] [ 6.568924145279999e-15 -2.56348259328e-15 3.2043532416e-15 ] [ 2.355199632576e-14 8.8119714144e-15 2.034764308416e-14 ] [ -2.146916671872e-14 -3.140266176767999e-14 1.44195895872e-14 ] [ -1.457980724928e-14 1.265719530432e-14 -1.28174129664e-15 ] [ -2.88391791744e-15 2.611547891904e-14 2.72370025536e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.222449 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.239993500312034e-18 } }