{ "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" [ [ 0.337417 0.676695 0.099645 ] [ 0.003401 0.002889 0.011812 ] [ 0.001194 0.998514 0.507712 ] [ 0.661325 0.331267 0.597748 ] [ 0.16307 0.818057 0.78183 ] [ 0.660009 0.829469 0.7862 ] [ 0.82595 0.65472 0.280955 ] [ 0.171226 0.340305 0.788368 ] [ 0.340697 0.170435 0.287472 ] [ 0.830954 0.171226 0.287727 ] [ 0.331787 0.659413 0.510159 ] [ 0.666227 0.329033 0.011737 ] [ 0.159273 0.8227 0.40491 ] [ 0.477475 0.961356 0.657804 ] [ 0.334609 0.689537 0.891174 ] [ 0.00169 0.985362 0.697251 ] [ 0.989555 0.984031 0.202094 ] [ 0.665298 0.823481 0.405573 ] [ 0.032854 0.527479 0.655114 ] [ 0.482819 0.520536 0.654825 ] [ 0.8336 0.665053 0.901529 ] [ 0.158988 0.321328 0.406592 ] [ 0.531236 0.498707 0.152185 ] [ 0.967992 0.498078 0.152804 ] [ 0.682622 0.357749 0.387822 ] [ 0.328207 0.156604 0.906578 ] [ 0.524781 0.044102 0.157097 ] [ 0.835449 0.161875 0.907442 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Cr" "Cr" "Cr" "Ni" "Ni" "Ni" "Sb" "Sb" "O" "O" "O" "O" "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" 5.89862518 "source-unit" "angstrom" } "b" { "source-value" 5.90942511 "source-unit" "angstrom" } "c" { "source-value" 9.60388731 "source-unit" "angstrom" } "alpha" { "source-value" 90.79657375 "source-unit" "degree" } "beta" { "source-value" 90.23557309 "source-unit" "degree" } "gamma" { "source-value" 119.73360684 "source-unit" "degree" } }