{ "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" [ [ 0.5343861 -0.3186706 -1.7200445 ] [ -2.3488059 -0.4019354 2.0124444 ] [ 0.7446871 0.7670071 -2.0442812 ] [ -2.0010121 2.2838419 -1.4179894 ] [ 0.0747673 -0.8147297 2.2433676 ] [ -0.7840112 -0.6776883 2.0355453 ] [ 3.5386497 0.1230293 -1.4708499 ] [ 0.241339 -0.9608543 0.3618078 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.561809229543872e-10 -5.105665892627604e-10 -2.755815107340212e-09 ] [ -3.76320193078134e-09 -6.439715062574435e-10 3.224291394904149e-09 ] [ 1.193120271261221e-09 1.228880853732101e-09 -3.27529957196548e-09 ] [ -3.205974830971271e-09 3.659118127930164e-09 -2.271869483939679e-09 ] [ 1.197904210472682e-10 -1.30534088836583e-09 3.594271150192658e-09 ] [ -1.256124425434301e-09 -1.085776359395182e-09 3.26130311710852e-09 ] [ 5.669541865251109e-09 1.971146697573762e-10 -2.356561341901236e-09 ] [ 3.866677066729259e-10 -1.539458308138426e-09 5.796800031589452e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.381858 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.668798615510597e-18 } }