{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1/m" } "basis-atom-coordinates" { "source-value" [ [ 0.56023 0.25 0.158434 ] [ 0.43977 0.75 0.841566 ] [ 0.618956 0.75 0.027594 ] [ 0.225056 0.25 0.091184 ] [ 0.967122 0.75 0.061885 ] [ 0.196023 0.25 0.254787 ] [ 0.453947 0.75 0.283782 ] [ 0.041459 0.25 0.36733 ] [ 0.803676 0.75 0.313008 ] [ 0.394014 0.25 0.406328 ] [ 0.651726 0.75 0.429394 ] [ 0.348274 0.25 0.570606 ] [ 0.605986 0.75 0.593672 ] [ 0.196324 0.25 0.686992 ] [ 0.958541 0.75 0.63267 ] [ 0.546053 0.25 0.716218 ] [ 0.803977 0.75 0.745213 ] [ 0.032878 0.25 0.938115 ] [ 0.774944 0.75 0.908816 ] [ 0.381044 0.25 0.972406 ] [ 0.579664 0.25 0.005623 ] [ 0.169582 0.75 0.07887 ] [ 0.789411 0.75 0.012474 ] [ 0.388482 0.25 0.095127 ] [ 0.001341 0.25 0.04599 ] [ 0.636985 0.75 0.104257 ] [ 0.213132 0.25 0.171272 ] [ 0.036072 0.25 0.247775 ] [ 0.935097 0.75 0.13104 ] [ 0.492485 0.75 0.213361 ] [ 0.253994 0.75 0.264044 ] [ 0.767724 0.75 0.237235 ] [ 0.428267 0.25 0.301467 ] [ 0.212348 0.25 0.353642 ] [ 0.635569 0.75 0.333946 ] [ 0.060696 0.25 0.441994 ] [ 0.421459 0.75 0.389155 ] [ 0.840604 0.25 0.33484 ] [ 0.00001 0.75 0.343208 ] [ 0.595066 0.25 0.425865 ] [ 0.362529 0.25 0.479932 ] [ 0.811475 0.75 0.437344 ] [ 0.188525 0.25 0.562656 ] [ 0.637471 0.75 0.520068 ] [ 0.404934 0.75 0.574135 ] [ 0.159396 0.75 0.66516 ] [ 0.578541 0.25 0.610845 ] [ 0.939304 0.75 0.558006 ] [ 0.364431 0.25 0.666054 ] [ 0.787652 0.75 0.646358 ] [ 0.571733 0.75 0.698533 ] [ 0.232276 0.25 0.762765 ] [ 0.99999 0.25 0.656792 ] [ 0.746006 0.25 0.735956 ] [ 0.507515 0.25 0.786639 ] [ 0.064903 0.25 0.86896 ] [ 0.963928 0.75 0.752225 ] [ 0.786868 0.75 0.828728 ] [ 0.363015 0.25 0.895743 ] [ 0.998659 0.75 0.95401 ] [ 0.611518 0.75 0.904873 ] [ 0.210589 0.25 0.987526 ] [ 0.830418 0.25 0.92113 ] [ 0.420336 0.75 0.994377 ] ] } "species" { "source-value" [ "Li" "Li" "V" "V" "V" "V" "V" "V" "V" "V" "V" "V" "V" "V" "V" "V" "V" "V" "V" "V" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "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" 10.28327657 "source-unit" "angstrom" } "b" { "source-value" 3.65617744 "source-unit" "angstrom" } "c" { "source-value" 21.67578224 "source-unit" "angstrom" } "beta" { "source-value" 101.58203492 "source-unit" "degree" } }