{ "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" [ 5.52208 0 0 ] "si-unit" "m" "si-value" [ 5.52208e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0968577 5.45697 0 ] "si-unit" "m" "si-value" [ -9.68577e-12 5.456970000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.137264 0.147448 5.57607 ] "si-unit" "m" "si-value" [ 1.37264e-11 1.47448e-11 5.57607e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1117744 0.2380357 -0.5297289 ] [ 0.5110121 -0.752459 -0.4063667 ] [ -0.832831 0.8371463 0.4755472 ] [ -1.5446838 1.8200367 -1.1214839 ] [ -0.3814887 -0.334469 -0.2018674 ] [ 1.7245732 -1.050789 -0.355251 ] [ 0.1969189 -0.7058778 1.1834749 ] [ 0.4382737 -0.051624 0.9556759 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.790823304839475e-10 3.813752334557626e-10 -8.48719258942101e-10 ] [ 8.187316395659116e-10 -1.205572217910547e-09 -6.510712262116474e-10 ] [ -1.334342357277485e-09 1.341256230049223e-09 7.619106059269018e-10 ] [ -2.474856270888503e-09 2.916020249737983e-09 -1.796815285183605e-09 ] [ -6.11212276239385e-10 -5.358784121823552e-10 -3.234272287816819e-10 ] [ 2.763070861898243e-09 -1.683549569193811e-09 -5.691748467158207e-10 ] [ 3.154988577736531e-10 -1.130940908301738e-09 1.896135816083618e-09 ] [ 7.02191875651513e-10 -8.271076587217921e-11 1.531161584041999e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.427647 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.836352437415526e-18 } }