{ "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" [ [ -0.1117745 0.2380357 -0.5297288 ] [ 0.511012 -0.7524588 -0.4063666 ] [ -0.8328309 0.8371461 0.475547 ] [ -1.5446833 1.8200363 -1.1214834 ] [ -0.3814887 -0.334469 -0.2018673 ] [ 1.724573 -1.0507888 -0.3552509 ] [ 0.1969187 -0.7058775 1.1834743 ] [ 0.4382737 -0.051624 0.9556757 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.79082492177033e-10 3.813752365978337e-10 -8.487191057168592e-10 ] [ 8.18731486093608e-10 -1.205571907407679e-09 -6.510710713580243e-10 ] [ -1.33434220805319e-09 1.341255920664227e-09 7.61910291768798e-10 ] [ -2.474855490190012e-09 2.916019632891814e-09 -1.796814498898875e-09 ] [ -6.112122812750358e-10 -5.358784165973459e-10 -3.234270712286682e-10 ] [ 2.763070564227281e-09 -1.683549262628899e-09 -5.691746911874705e-10 ] [ 3.154985399376558e-10 -1.130940436966335e-09 1.896134870399506e-09 ] [ 7.021918814367257e-10 -8.271076655361599e-11 1.531161276221594e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.427648 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.836352645717682e-18 } }