{ "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" [ [ -1.7173154 -0.9906879 -1.2226718 ] [ 2.0499587 1.2546208 1.8598285 ] [ -0.7292313 1.5614186 -1.5654433 ] [ -0.4723021 0.0837505 0.8759338 ] [ -1.241837 -1.4227328 -3.5118914 ] [ 2.4391659 -0.4757756 -1.4569927 ] [ -1.0508433 0.7670025 3.9711602 ] [ 0.7224045 -0.7775961 1.0500767 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.7514425844198e-09 -1.587256991889448e-09 -1.958936172871454e-09 ] [ 3.284395902745561e-09 2.010124113729393e-09 2.979773741397533e-09 ] [ -1.168357340015591e-09 2.501668376202267e-09 -2.508116656448001e-09 ] [ -7.567113825747437e-10 1.341830930803104e-10 1.403400655728503e-09 ] [ -1.98964220824441e-09 -2.279469229805322e-09 -5.626670295868582e-09 ] [ 3.90797457923259e-09 -7.622765430670925e-10 -2.334359640616268e-09 ] [ -1.68363656738432e-09 1.228873473595152e-09 6.362500029891452e-09 ] [ 1.157419600660714e-09 -1.245846291845259e-09 1.682408338786815e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.330541 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.820794341121585e-18 } }