{ "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" [ 5.47211 0 0 ] "si-unit" "m" "si-value" [ 5.47211e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.102197 5.35978 0 ] "si-unit" "m" "si-value" [ 1.02197e-11 5.35978e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0185088 0.0167086 5.27242 ] "si-unit" "m" "si-value" [ 1.85088e-12 1.67086e-12 5.27242e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0278677 0.000879346 0.114128 ] [ 1.32251 1.35955 1.26618 ] [ 0.0215185 2.57215 2.76138 ] [ 1.39174 4.08684 3.88021 ] [ 2.74481 0.155651 2.83937 ] [ 4.07982 1.36064 4.14567 ] [ 2.72904 2.76199 -0.16614 ] [ 4.049 4.11184 1.31405 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.78677e-12 8.79346e-14 1.14128e-11 ] [ 1.32251e-10 1.35955e-10 1.26618e-10 ] [ 2.15185e-12 2.57215e-10 2.76138e-10 ] [ 1.39174e-10 4.08684e-10 3.88021e-10 ] [ 2.74481e-10 1.55651e-11 2.83937e-10 ] [ 4.07982e-10 1.36064e-10 4.14567e-10 ] [ 2.72904e-10 2.76199e-10 -1.6614e-11 ] [ 4.049000000000001e-10 4.11184e-10 1.31405e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2030165 -1.0693786 -1.3582357 ] [ 2.1409092 1.0986174 1.4040362 ] [ -0.2838295 1.0551318 -0.9111518 ] [ -0.8386982 0.2903023 0.4202678 ] [ -1.1442478 -1.1729802 -2.8022816 ] [ 2.2544747 -0.6272282 -1.0798372 ] [ -1.1419815 0.8062486 3.7057469 ] [ 0.2163895 -0.380713 0.6214554 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.927444910736643e-09 -1.713333391703835e-09 -2.176133484075923e-09 ] [ 3.430114667495631e-09 1.760179113484082e-09 2.249513974396873e-09 ] [ -4.547449891933537e-10 1.690507501822622e-09 -1.459826111959837e-09 ] [ -1.343742647947043e-09 4.651155580244678e-10 6.733432436350503e-10 ] [ -1.833287073561834e-09 -1.879321453101308e-09 -4.489750064418018e-09 ] [ 3.612066656525094e-09 -1.004930357946467e-09 -1.730089916110134e-09 ] [ -1.829656060686115e-09 1.291752657472731e-09 5.937261045782075e-09 ] [ 3.466941978866016e-10 -6.099694678346305e-10 9.956813127499124e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -34.774957 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.571562309472531e-18 } }