{ "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" [ 5.49393 0 0 ] "si-unit" "m" "si-value" [ 5.49393e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.002595 5.45604 0 ] "si-unit" "m" "si-value" [ 2.595e-13 5.45604e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0698117 0.0748179 5.57684 ] "si-unit" "m" "si-value" [ -6.981170000000001e-12 7.48179e-12 5.57684e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0568347 0.000259582 0.0366732 ] [ 1.4042 1.34788 1.25876 ] [ -0.0116956 2.70772 2.89683 ] [ 1.4664 4.01047 4.21293 ] [ 2.72042 0.0465962 2.58375 ] [ 4.04434 1.40284 4.02526 ] [ 2.59741 2.72967 0.138309 ] [ 4.11134 4.10597 1.37335 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.683470000000001e-12 2.59582e-14 3.66732e-12 ] [ 1.4042e-10 1.34788e-10 1.25876e-10 ] [ -1.16956e-12 2.70772e-10 2.89683e-10 ] [ 1.4664e-10 4.01047e-10 4.21293e-10 ] [ 2.72042e-10 4.65962e-12 2.583750000000001e-10 ] [ 4.04434e-10 1.40284e-10 4.02526e-10 ] [ 2.59741e-10 2.72967e-10 1.38309e-11 ] [ 4.11134e-10 4.10597e-10 1.37335e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.7246369 -0.4745634 -1.6732626 ] [ -2.1611978 -0.1854635 1.9427568 ] [ 0.7341589 0.3500516 -1.8675009 ] [ -1.768861 2.104005 -0.73749 ] [ 0.1636704 -0.7409088 1.5055617 ] [ -0.9317682 -0.1814026 1.9443959 ] [ 3.1648791 -0.2049937 -1.6406041 ] [ 0.0744816 -0.6667245 0.5261431 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.160996299748988e-09 -7.603343845673588e-10 -2.680862218179022e-09 ] [ -3.462620588084395e-09 -2.971452837117408e-10 3.112639524860222e-09 ] [ 1.176252225532245e-09 5.608444895936333e-10 -2.992066281302959e-09 ] [ -2.834027739644909e-09 3.370987621046304e-09 -1.181589236073792e-09 ] [ 2.622288883969843e-10 -1.187066757504983e-09 2.412175756911903e-09 ] [ -1.492857226044899e-09 -2.906390046723341e-10 3.115265652559375e-09 ] [ 5.070695301678545e-09 -3.28436113551289e-10 -2.628537533008626e-09 ] [ 1.193326781997773e-10 -1.06821040641457e-09 8.429741740152365e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -22.444749 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.596045210752419e-18 } }