{ "property-id" "tag:brunnels@noreply.openkim.org,2016-02-18:property/grain-boundary-symmetric-tilt-energy-relaxed-relation-cubic-crystal" "instance-id" 1 "a" { "source-value" 4.032082714140415 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.032082714140415e-10 } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0 0.5 0.5 ] [ 0.5 0 0.5 ] [ 0.5 0.5 0 ] ] } "minimum-atom-separation" { "source-value" [ 2.7887406907512 2.59885844728584 2.52095501682339 2.53694103220512 2.57292531282234 2.61405776510543 2.5242311911549 2.60222285881982 2.50499596889578 2.57621827198205 2.56661799996225 2.61249480200305 2.56717043748467 2.57610362749005 2.5718476799883 2.58608707672472 2.59353701625405 2.57896936600181 2.56388482954506 2.55240161112647 2.58276486657134 2.58070318958078 2.83249381732342 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.7887406907512e-10 2.5988584472858397e-10 2.52095501682339e-10 2.53694103220512e-10 2.57292531282234e-10 2.6140577651054303e-10 2.5242311911548997e-10 2.60222285881982e-10 2.50499596889578e-10 2.57621827198205e-10 2.56661799996225e-10 2.61249480200305e-10 2.5671704374846703e-10 2.57610362749005e-10 2.5718476799883e-10 2.58608707672472e-10 2.59353701625405e-10 2.57896936600181e-10 2.56388482954506e-10 2.5524016111264703e-10 2.58276486657134e-10 2.58070318958078e-10 2.8324938173234203e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.010444204479035324 0.4712180569520391 0.48483284143667926 0.49356997473558123 0.5069572225067026 0.5233143819191665 0.5159477017571467 0.4842929318171771 0.5309013529436789 0.5178165615625148 0.5235648153004091 0.47218106418051875 0.4925388095884815 0.4723089265739242 0.47407153776505473 0.4314741198206788 0.4287220760486592 0.39280051710344877 0.36606628735311897 0.33877216001640414 0.31659939513299434 0.2867653846884536 0.011810498514250816 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.010444204479035324 0.4712180569520391 0.48483284143667926 0.49356997473558123 0.5069572225067026 0.5233143819191665 0.5159477017571467 0.4842929318171771 0.5309013529436789 0.5178165615625148 0.5235648153004091 0.47218106418051875 0.4925388095884815 0.4723089265739242 0.47407153776505473 0.4314741198206788 0.4287220760486592 0.39280051710344877 0.36606628735311897 0.33877216001640414 0.31659939513299434 0.2867653846884536 0.011810498514250816 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 1 1 25 9 25 17 53 9 73 7 29 5 1 17 89 13 37 25 41 15 85 113 1 ] } "species" { "source-value" [ "Al" "Al" "Al" "Al" ] } "tilt-angle" { "source-value" [ 0.0 14.250032697803595 16.26020470831196 18.924644416051233 22.619864948040426 28.072486935852957 31.890791801845708 36.86989764584402 41.112090439166934 43.60281897270362 46.39718102729638 53.13010235415598 59.48976259388444 61.92751306414704 64.01076641616699 67.38013505195957 71.07535558394876 73.73979529168804 77.31961650818018 79.61114218453038 81.20258929000894 82.3718503314193 90.0 ] "source-unit" "degrees" "si-unit" "radian" "si-value" [ 0.0 0.24870998909352293 0.2837941092083279 0.3302973548292537 0.3947911196997616 0.4899573262537284 0.5565993180102228 0.6435011087932845 0.7175413405411447 0.7610127542247299 0.809783572570167 0.9272952180016124 1.038292228493046 1.0808390005411685 1.117198630687125 1.1760052070951352 1.2404989719656432 1.287002217586569 1.3494818844471055 1.3894765523934065 1.417252544255341 1.4376599992432493 1.570796326794897 ] } "tilt-axis" { "source-value" [ 0 0 1 ] } }