{ "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" [ 5.50751 0 0 ] "si-unit" "m" "si-value" [ 5.50751e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0552432 5.46365 0 ] "si-unit" "m" "si-value" [ 5.52432e-12 5.46365e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.041151 -0.173599 5.4807 ] "si-unit" "m" "si-value" [ -4.115100000000001e-12 -1.73599e-11 5.4807e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0203681 -0.0104771 -0.043973 ] [ 1.36957 1.30557 1.36025 ] [ 0.0138031 2.57027 2.84477 ] [ 1.29725 4.08516 4.13225 ] [ 2.77149 -0.00701058 2.61036 ] [ 3.98017 1.30013 4.07827 ] [ 2.6961 2.74296 0.249943 ] [ 4.17055 4.00651 1.44609 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.03681e-12 -1.04771e-12 -4.3973e-12 ] [ 1.36957e-10 1.30557e-10 1.36025e-10 ] [ 1.38031e-12 2.57027e-10 2.84477e-10 ] [ 1.29725e-10 4.08516e-10 4.13225e-10 ] [ 2.77149e-10 -7.01058e-13 2.61036e-10 ] [ 3.98017e-10 1.30013e-10 4.07827e-10 ] [ 2.6961e-10 2.74296e-10 2.49943e-11 ] [ 4.170550000000001e-10 4.00651e-10 1.44609e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.2303729 1.032498 1.0012304 ] [ -0.8171847 -0.1828298 0.341684 ] [ -0.3273873 0.6276216 -0.3391768 ] [ 2.3194991 -1.4885661 -0.8484594 ] [ -0.9091087 -0.8440364 1.2381199 ] [ 0.6671784 -0.1432742 1.4420758 ] [ -0.0182057 0.6953056 -2.5766782 ] [ 1.3155818 0.3032812 -0.2587958 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.573451316045896e-09 1.654244156622758e-09 1.604147938914233e-09 ] [ -1.309274221215462e-09 -2.929256311455398e-10 5.474381165014272e-10 ] [ -5.245322780068358e-10 1.005560654229089e-09 -5.434211392777574e-10 ] [ 3.716247229986641e-09 -2.384945803935435e-09 -1.359381814377995e-09 ] [ -1.456552704905881e-09 -1.352295387184197e-09 1.983686757527234e-09 ] [ 1.068937634382751e-09 -2.295505736038233e-10 2.310460132181457e-09 ] [ -2.916874690529856e-11 1.114002376631316e-09 -4.128293571365026e-09 ] [ 2.107794402709981e-09 4.859100481681689e-10 -4.146365803212327e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -17.207399038775915 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.756929244470316e-18 } }