{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.52208e-10 0.0 0.0 ] "source-value" [ 5.52208 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -9.68577e-12 5.456970000000001e-10 0.0 ] "source-value" [ -0.0968577 5.45697 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.37264e-11 1.47448e-11 5.57607e-10 ] "source-value" [ 0.137264 0.147448 5.57607 ] } "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" [ [ -3.613517107019903e-11 4.848082313060449e-10 -1.123833973247194e-09 ] [ 7.570327792048763e-10 -1.374325155502535e-09 -6.456840675418694e-10 ] [ -1.465691840786248e-09 1.440946703530978e-09 7.424257349530426e-10 ] [ -2.46535007634431e-09 2.442823152620538e-09 -1.867650717942415e-09 ] [ -4.165531039950336e-10 -4.952541024383366e-10 -3.455502437793504e-10 ] [ 2.424054134160853e-09 -1.609991557703276e-09 -5.476170796299705e-10 ] [ 4.739422694637792e-10 -8.687825156760692e-10 2.244706323010839e-09 ] [ 7.287010093662835e-10 -2.022491635500672e-11 1.543204024176918e-09 ] ] "source-value" [ [ -0.0225538 0.3025935 -0.701442 ] [ 0.4725027 -0.8577863 -0.4030043 ] [ -0.9148129 0.8993682 0.4633857 ] [ -1.5387505 1.5246903 -1.1656959 ] [ -0.259992 -0.3091133 -0.2156755 ] [ 1.5129756 -1.0048777 -0.3417957 ] [ 0.2958115 -0.5422514 1.4010355 ] [ 0.4548194 -0.0126234 0.9631922 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.38032e-12 3.41723e-12 -1.13332e-11 ] [ 1.31844e-10 1.45238e-10 1.31404e-10 ] [ 8.8982e-13 2.79356e-10 2.65987e-10 ] [ 1.44046e-10 4.10222e-10 4.12461e-10 ] [ 2.80067e-10 1.27474e-11 2.69388e-10 ] [ 4.04292e-10 1.57371e-10 4.10996e-10 ] [ 2.66616e-10 2.79739e-10 -1.10182e-11 ] [ 4.024460000000001e-10 4.16186e-10 1.2374e-10 ] ] "source-value" [ [ -0.0138032 0.0341723 -0.113332 ] [ 1.31844 1.45238 1.31404 ] [ 0.0088982 2.79356 2.65987 ] [ 1.44046 4.10222 4.12461 ] [ 2.80067 0.127474 2.69388 ] [ 4.04292 1.57371 4.10996 ] [ 2.66616 2.79739 -0.110182 ] [ 4.02446 4.16186 1.2374 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.848837719168434e-18 "source-value" -36.505574 } }