{ "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" [ [ -1.2629786 -0.0936031 -1.249026 ] [ 1.2512229 0.5161654 1.1136072 ] [ -0.6165853 1.0833391 -0.8379888 ] [ 0.1889115 0.023806 1.0613051 ] [ -0.9123464 -0.8123446 -1.8875306 ] [ 1.2735067 -0.2214478 -0.8204307 ] [ -0.712878 0.0313535 1.967997 ] [ 0.7911473 -0.5272685 0.6520669 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.023514785490715e-09 -1.499686984544045e-10 -2.001160255971341e-09 ] [ 2.004680077789576e-09 8.269881363458804e-10 1.78419542059455e-09 ] [ -9.878785523889543e-10 1.735700578418514e-09 -1.342606063852247e-09 ] [ 3.026695887002592e-10 3.81414166347648e-11 1.700398218755806e-09 ] [ -1.461740072151045e-09 -1.301519526153128e-09 -3.024157398364597e-09 ] [ 2.040382661172159e-09 -3.547984878875942e-10 -1.314474886526578e-09 ] [ -1.142156465082663e-09 5.02338446802528e-11 3.153078783204537e-09 ] [ 1.267557707669044e-09 -8.447772635842849e-10 1.044726342377532e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.584426 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.861471202258766e-18 } }