{ "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" [ [ -3.603620462033222e-10 5.112455875082035e-10 -1.288435510997026e-09 ] [ 1.007571065452869e-09 -1.541790103309062e-09 -7.675480245848487e-10 ] [ -1.81925537093453e-09 1.751909799291147e-09 8.699947225073665e-10 ] [ -2.851394693343732e-09 3.388688468352902e-09 -2.008049134787795e-09 ] [ -7.912161787156167e-10 -7.102541886250407e-10 -3.624982282918349e-10 ] [ 3.533947248195141e-09 -2.161633945875345e-09 -5.590745650806355e-10 ] [ 1.583767611427008e-10 -1.193875367272735e-09 2.184300739618113e-09 ] [ 1.122333374624152e-09 -4.429041028773312e-11 1.931309841398999e-09 ] ] "source-value" [ [ -0.2249203 0.3190944 -0.8041782 ] [ 0.6288764 -0.9623097 -0.4790658 ] [ -1.1354899 1.0934561 0.543008 ] [ -1.7797006 2.115053 -1.2533257 ] [ -0.4938383 -0.4433058 -0.2262536 ] [ 2.2057164 -1.3491858 -0.3489469 ] [ 0.098851 -0.7451584 1.3633333 ] [ 0.7005054 -0.0276439 1.2054288 ] ] } "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" -5.818315773889209e-18 "source-value" -36.315071 } }