{ "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" [ [ 0.006721 0.374532 0.74594 ] [ 0.002522 0.113022 0.252307 ] [ 0.998117 0.504804 0.001985 ] [ 0.994513 0.877671 0.752031 ] [ 0.998544 0.261148 0.498969 ] [ 0.001041 0.635875 0.249996 ] [ 0.497283 0.184683 0.877787 ] [ 0.502506 0.559571 0.623154 ] [ 0.493018 0.93054 0.381942 ] [ 0.513867 0.308347 0.119428 ] [ 0.479493 0.696483 0.876599 ] [ 0.522098 0.057596 0.620526 ] [ 0.49295 0.439657 0.372598 ] [ 0.500308 0.811316 0.125699 ] [ 0.283212 0.778749 0.307774 ] [ 0.28412 0.152339 0.070128 ] [ 0.265643 0.524378 0.813151 ] [ 0.28192 0.9077 0.552775 ] [ 0.281387 0.272516 0.306502 ] [ 0.281234 0.633874 0.069263 ] [ 0.282203 0.037359 0.800915 ] [ 0.291223 0.390729 0.559795 ] [ 0.715292 0.599263 0.431751 ] [ 0.708163 0.972393 0.201019 ] [ 0.716662 0.353474 0.948089 ] [ 0.716009 0.719034 0.694589 ] [ 0.719034 0.106708 0.430658 ] [ 0.723976 0.471908 0.186259 ] [ 0.709187 0.84802 0.938951 ] [ 0.737755 0.226308 0.689421 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "V" "V" "V" "V" "V" "V" "Cr" "Cr" "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" 5.21721771 "source-unit" "angstrom" } "b" { "source-value" 5.97288499 "source-unit" "angstrom" } "c" { "source-value" 10.70777416 "source-unit" "angstrom" } "alpha" { "source-value" 73.80652105 "source-unit" "degree" } "beta" { "source-value" 75.96538003 "source-unit" "degree" } "gamma" { "source-value" 73.11347503 "source-unit" "degree" } }