{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.45804e-10 0.0 0.0 ] "source-value" [ 5.45804 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.57167e-12 5.395870000000001e-10 0.0 ] "source-value" [ -0.0357167 5.39587 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.9829e-12 -6.10013e-12 5.23355e-10 ] "source-value" [ 0.019829 -0.0610013 5.23355 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.047022357605735e-08 1.23726623549672e-08 1.138121207023749e-08 ] [ -3.079685667731815e-08 -1.560566780172995e-08 1.902411974494979e-08 ] [ -5.21932217721303e-09 -2.301338427982723e-08 -1.592533199828236e-08 ] [ 2.118383941019861e-08 -4.05372330468547e-09 1.034078452795123e-08 ] [ 2.75532321641304e-09 1.408043443140257e-09 -4.084164019610022e-09 ] [ 3.637360218837663e-09 3.330772987864223e-09 2.966255376159533e-10 ] [ 1.875566143363348e-08 2.386315937316245e-08 -1.871590662514157e-08 ] [ 1.542179912880903e-10 1.698137227108533e-09 -2.317339077502861e-09 ] ] "source-value" [ [ -6.5349996 7.7224085 7.1035939 ] [ -19.2218862 -9.7402918 11.8739217 ] [ -3.2576447 -14.3638248 -9.9398105 ] [ 13.2219127 -2.5301351 6.4542101 ] [ 1.7197375 0.8788316 -2.5491347 ] [ 2.2702617 2.078905 0.1851391 ] [ 11.7063632 14.8942127 -11.6815502 ] [ 0.0962553 1.0598939 -1.4463693 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 8.720550000000001e-12 -4.52445e-11 -7.13075e-12 ] [ 1.44372e-10 1.30265e-10 8.526040000000001e-11 ] [ 8.44836e-12 2.96191e-10 2.59679e-10 ] [ 1.14061e-10 3.90928e-10 3.87091e-10 ] [ 2.7873e-10 -3.19613e-11 3.1468e-10 ] [ 4.071170000000001e-10 1.23968e-10 4.05459e-10 ] [ 2.72619e-10 2.52806e-10 3.79157e-11 ] [ 3.92833e-10 3.98172e-10 1.55502e-10 ] ] "source-value" [ [ 0.0872055 -0.452445 -0.0713075 ] [ 1.44372 1.30265 0.852604 ] [ 0.0844836 2.96191 2.59679 ] [ 1.14061 3.90928 3.87091 ] [ 2.7873 -0.319613 3.1468 ] [ 4.07117 1.23968 4.05459 ] [ 2.72619 2.52806 0.379157 ] [ 3.92833 3.98172 1.55502 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.8772103848483e-18 "source-value" -24.199644 } }