{ "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" [ 5.44445 0 0 ] "si-unit" "m" "si-value" [ 5.44445e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.167308 5.39053 0 ] "si-unit" "m" "si-value" [ 1.67308e-11 5.39053e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.00577721 0.0671422 5.23553 ] "si-unit" "m" "si-value" [ 5.77721e-13 6.71422e-12 5.23553e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0663122 0.114884 -0.548352 ] [ 1.65266 1.49476 1.67932 ] [ 0.0154179 2.74054 2.60324 ] [ 1.52833 4.11061 4.06642 ] [ 2.73369 0.0515698 2.61947 ] [ 3.80738 1.47511 4.06717 ] [ 2.81179 3.14543 -0.204063 ] [ 4.02065 4.01269 1.26672 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.63122e-12 1.14884e-11 -5.48352e-11 ] [ 1.65266e-10 1.49476e-10 1.67932e-10 ] [ 1.54179e-12 2.74054e-10 2.60324e-10 ] [ 1.52833e-10 4.11061e-10 4.06642e-10 ] [ 2.733690000000001e-10 5.15698e-12 2.61947e-10 ] [ 3.807380000000001e-10 1.47511e-10 4.06717e-10 ] [ 2.81179e-10 3.14543e-10 -2.04063e-11 ] [ 4.02065e-10 4.01269e-10 1.26672e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.1690189 2.8114303 7.314138 ] [ -4.9970991 1.7323621 -8.732665 ] [ -0.8907355 -0.0771129 -1.6069304 ] [ -8.7566093 1.0592302 -3.8696113 ] [ 2.0707139 -2.9899723 -1.7326946 ] [ 0.4455263 0.9946901 2.177454 ] [ 2.0460774 -6.0066851 5.5448764 ] [ 7.9131074 2.4760576 0.9054329 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.475151400284383e-09 4.50440793477961e-09 1.171854100145149e-08 ] [ -8.006235415802428e-09 2.775550078247171e-09 -1.399127181554961e-08 ] [ -1.427115605174307e-09 -1.235484865599786e-10 -2.574586339344273e-09 ] [ -1.402963481352709e-08 1.697073876467146e-09 -6.199800807522363e-09 ] [ 3.317649426279012e-09 -4.790463755367237e-09 -2.776082801977976e-09 ] [ 7.13811827692474e-10 1.593669236291123e-09 3.488665920409835e-09 ] [ 3.278177401635471e-09 -9.623770515015952e-09 8.883871406498037e-09 ] [ 1.267819577861249e-08 3.967081631158117e-09 1.450663436034859e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -325.24468 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.210994266288071e-17 } }