{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.47225 0 0 ] "si-unit" "m" "si-value" [ 5.47225e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0720088 5.55574 0 ] "si-unit" "m" "si-value" [ -7.20088e-12 5.55574e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0610026 -0.0268755 5.37267 ] "si-unit" "m" "si-value" [ -6.10026e-12 -2.68755e-12 5.37267e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0205094 -0.0758047 0.142316 ] [ 1.30951 1.38319 1.48801 ] [ -0.0602099 2.69484 2.70363 ] [ 1.30902 4.05591 4.11478 ] [ 2.76224 0.0853385 2.86654 ] [ 4.01949 1.17816 4.04456 ] [ 2.72232 2.71295 0.0698342 ] [ 4.15368 4.12703 1.42088 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.05094e-12 -7.580470000000001e-12 1.42316e-11 ] [ 1.30951e-10 1.38319e-10 1.48801e-10 ] [ -6.02099e-12 2.69484e-10 2.70363e-10 ] [ 1.30902e-10 4.05591e-10 4.11478e-10 ] [ 2.76224e-10 8.53385e-12 2.86654e-10 ] [ 4.01949e-10 1.17816e-10 4.04456e-10 ] [ 2.72232e-10 2.71295e-10 6.983420000000001e-12 ] [ 4.15368e-10 4.127030000000001e-10 1.42088e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5667335000000001 0.6969150000000001 -1.1172702000000003 ] [ 1.2957174000000002 -0.8575556000000002 -1.0974803000000002 ] [ -0.4881677000000001 0.25871720000000004 1.8387429000000004 ] [ -0.056247800000000014 0.6416557000000002 -0.31057650000000003 ] [ -4.572848400000001 -3.1405657000000007 -2.6067010000000006 ] [ 3.753450200000001 3.957582000000001 3.408859600000001 ] [ 0.39734550000000013 -0.19383970000000006 0.36593680000000006 ] [ -0.8959827000000002 -1.3629089000000003 -0.4815114000000001 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.080071714050391e-10 1.11658092888411e-09 -1.790064208304507e-09 ] [ 2.075968142547232e-09 -1.373955544675851e-09 -1.75835729293531e-09 ] [ -7.821308824135219e-10 4.145106526539048e-10 2.945990910313399e-09 ] [ -9.011891087390521e-11 1.028045769612914e-09 -4.97598411369501e-10 ] [ -7.326510857304286e-09 -5.031740982081854e-09 -4.176395434024434e-09 ] [ 6.013690207322627e-09 6.340745407538988e-09 5.461595199706588e-09 ] [ 6.366176757250472e-10 -3.105654380815699e-10 5.862953904807313e-10 ] [ -1.435522546408232e-09 -2.183620793850643e-09 -7.714663140846276e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -33.984623 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.444936888589898e-18 } }