{ "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" [ [ -0.5554098 0.170548 -0.5006289 ] [ 0.7318376 -1.0350609 -0.5151319 ] [ -1.3286404 1.0821944 0.662827 ] [ -1.8424269 2.7290682 -1.4007786 ] [ -0.7587519 -0.5688331 -0.1437706 ] [ 2.8415869 -1.5981999 -0.5821501 ] [ -0.1607646 -0.9730185 1.2614645 ] [ 1.0725691 0.1933017 1.2181687 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.898645965232038e-10 2.732480183241984e-10 -8.020959192768212e-10 ] [ 1.172533092942382e-09 -1.658350375084207e-09 -8.253322868082834e-10 ] [ -2.12871658633036e-09 1.733866566840683e-09 1.061965923035002e-09 ] [ -2.95189330471302e-09 4.372449266608738e-09 -2.244294723836955e-09 ] [ -1.21565455516758e-09 -9.113710939571885e-10 -2.303458940783885e-10 ] [ 4.552724097151547e-09 -2.560598515144898e-09 -9.327072800163822e-10 ] [ -2.575732835722637e-10 -1.558947492305885e-09 2.021088929869162e-09 ] [ 1.718445136212497e-09 3.097034645008954e-10 1.951721411330329e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.155428 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.792738145661771e-18 } }