{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.31945e-10 0.0 0.0 ] "source-value" [ 5.31945 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.83334e-13 5.416950000000001e-10 0.0 ] "source-value" [ -0.00383334 5.41695 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.89848e-12 -1.18491e-11 5.47074e-10 ] "source-value" [ 0.0189848 -0.118491 5.47074 ] } "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" [ [ 3.458807728162215e-10 2.26379545635936e-10 8.895260566032289e-10 ] [ -2.219687533988736e-10 5.98046550075623e-10 -1.295488933352436e-09 ] [ 2.774897008189354e-09 3.064963234719752e-09 -2.824832527582814e-09 ] [ -1.453501679966892e-09 -7.77391797743044e-10 -7.966707890211302e-10 ] [ -1.193382217308852e-09 3.367321840937913e-10 9.703044372530612e-10 ] [ 2.134804216618752e-11 -1.213046852499565e-09 3.787327635550771e-09 ] [ -1.020933859340989e-09 -1.35281321066804e-09 -4.892255924672526e-10 ] [ 7.476606868438446e-10 -8.828694933967911e-10 -2.409404472010906e-10 ] ] "source-value" [ [ 0.2158818 0.141295 0.5551985 ] [ -0.138542 0.3732713 -0.8085806 ] [ 1.7319545 1.9129996 -1.7631218 ] [ -0.9072044 -0.4852098 -0.4972428 ] [ -0.7448506 0.2101717 0.6056164 ] [ 0.0133244 -0.7571243 2.363864 ] [ -0.6372168 -0.8443596 -0.3053506 ] [ 0.4666531 -0.5510438 -0.1503832 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.47515e-12 -9.60157e-12 3.81768e-12 ] [ 1.54242e-10 1.27348e-10 1.38773e-10 ] [ -7.38039e-12 2.51333e-10 2.6891e-10 ] [ 1.45374e-10 4.04036e-10 4.07661e-10 ] [ 2.81495e-10 -3.09523e-12 2.80877e-10 ] [ 4.27456e-10 1.30079e-10 3.98727e-10 ] [ 2.73206e-10 2.74248e-10 -1.03972e-11 ] [ 3.9224e-10 4.04214e-10 1.39211e-10 ] ] "source-value" [ [ -0.0147515 -0.0960157 0.0381768 ] [ 1.54242 1.27348 1.38773 ] [ -0.0738039 2.51333 2.6891 ] [ 1.45374 4.04036 4.07661 ] [ 2.81495 -0.0309523 2.80877 ] [ 4.27456 1.30079 3.98727 ] [ 2.73206 2.74248 -0.103972 ] [ 3.9224 4.04214 1.39211 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 1.066332783589122e-16 "source-value" 665.55258 } }