{ "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" [ 5.42981 0 0 ] "si-unit" "m" "si-value" [ 5.42981e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0370196 5.47054 0 ] "si-unit" "m" "si-value" [ 3.70196e-12 5.47054e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0339139 -0.0143321 5.52419 ] "si-unit" "m" "si-value" [ -3.39139e-12 -1.43321e-12 5.52419e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0865271 0.0202603 -0.0485063 ] [ 1.27669 1.31148 1.22292 ] [ -0.0137625 2.6467 2.79128 ] [ 1.29807 4.01993 4.311 ] [ 2.70854 -0.0697941 2.82717 ] [ 4.06866 1.27154 4.01384 ] [ 2.71531 2.7055 0.0603487 ] [ 4.06455 4.01651 1.33765 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.65271e-12 2.02603e-12 -4.850630000000001e-12 ] [ 1.27669e-10 1.31148e-10 1.22292e-10 ] [ -1.37625e-12 2.6467e-10 2.79128e-10 ] [ 1.29807e-10 4.019929999999999e-10 4.311e-10 ] [ 2.70854e-10 -6.97941e-12 2.82717e-10 ] [ 4.06866e-10 1.27154e-10 4.01384e-10 ] [ 2.71531e-10 2.7055e-10 6.03487e-12 ] [ 4.06455e-10 4.016510000000001e-10 1.33765e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.1201781 -0.9892275 -0.4387835 ] [ 1.309315 0.764101 2.1584517 ] [ -0.0208264 0.152117 -0.8492191 ] [ 0.9402726 0.1025526 -1.2759917 ] [ -0.9951724 -0.5993545 -1.110427 ] [ 0.3528552 0.5964506 1.9015638 ] [ -0.2692527 -0.7786624 -1.1590188 ] [ 0.8029868 0.7520231 0.7734246 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.396899783752164e-09 -1.584917173152432e-09 -7.030086652927968e-10 ] [ 2.097753882262752e-09 1.224224758129901e-09 3.458220850866016e-09 ] [ -3.336757117542912e-11 2.437183010262336e-10 -1.360598987956817e-09 ] [ 1.50648277689883e-09 1.643073781222541e-10 -2.044364070074847e-09 ] [ -1.594441952945426e-09 -9.602717674712736e-10 -1.779100178505082e-09 ] [ 5.653363519677081e-10 9.556192067821326e-10 3.046641063319607e-09 ] [ -4.313903810272762e-10 -1.247554692776018e-09 -1.856952824427671e-09 ] [ 1.286526677771005e-09 1.20487382912154e-09 1.239162812071592e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.741108 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.886574425988784e-18 } }