{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-triclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P1" } "basis-atom-coordinates" { "source-value" [ [ 0.169638 0.552117 0.105798 ] [ 0.679066 0.063307 0.620539 ] [ 0.314877 0.930176 0.384384 ] [ 0.796272 0.044609 0.190502 ] [ 0.702333 0.457123 0.298717 ] [ 0.304917 0.533668 0.715376 ] [ 0.184462 0.949731 0.798214 ] [ 0.291685 0.199285 0.037734 ] [ 0.199289 0.274941 0.464112 ] [ 0.817305 0.748365 0.534303 ] [ 0.696312 0.781049 0.964419 ] [ 0.070696 0.265284 0.028843 ] [ 0.455241 0.134483 0.179613 ] [ 0.587496 0.72151 0.101495 ] [ 0.048582 0.357304 0.321839 ] [ 0.438814 0.23083 0.472572 ] [ 0.095266 0.224478 0.603447 ] [ 0.902607 0.776496 0.396351 ] [ 0.567118 0.766946 0.535741 ] [ 0.006895 0.709949 0.671764 ] [ 0.370857 0.220123 0.896514 ] [ 0.537828 0.853209 0.822 ] [ 0.948072 0.75664 0.972616 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Mn" "Mn" "Mn" "Mn" "B" "B" "B" "B" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.26094105 "source-unit" "angstrom" } "b" { "source-value" 6.17463559 "source-unit" "angstrom" } "c" { "source-value" 9.08919863 "source-unit" "angstrom" } "alpha" { "source-value" 108.04350354 "source-unit" "degree" } "beta" { "source-value" 89.02368057 "source-unit" "degree" } "gamma" { "source-value" 114.94703382 "source-unit" "degree" } }