{ "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" 3.615000009536743 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.615000009536743e-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" [ 2.47194510329979 2.29596125078261 2.28091960007123 2.28745201459152 2.36426894551467 2.35082058335823 2.26446161991209 2.32950498033772 2.28580656198535 2.29229701733648 2.27352418136352 2.32249025175616 2.28150694040127 2.3024505780159 2.28454716605556 2.31161187803772 2.32557883495143 2.33335436484217 2.33492966814789 2.32948439103694 2.33301209044996 2.33854874680263 2.54263611289649 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.47194510329979e-10 2.29596125078261e-10 2.28091960007123e-10 2.28745201459152e-10 2.36426894551467e-10 2.35082058335823e-10 2.26446161991209e-10 2.32950498033772e-10 2.28580656198535e-10 2.2922970173364799e-10 2.27352418136352e-10 2.3224902517561603e-10 2.28150694040127e-10 2.3024505780159e-10 2.28454716605556e-10 2.31161187803772e-10 2.32557883495143e-10 2.33335436484217e-10 2.3349296681478904e-10 2.32948439103694e-10 2.33301209044996e-10 2.33854874680263e-10 2.54263611289649e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.013691619059957128 0.7520571701150119 0.7861418383783155 0.8241049943177475 0.8624346662885827 0.9013282822657565 0.9283071418464753 0.8896912994758494 0.9621661369055691 0.9610393539205773 0.9724696788380245 0.9268308327069212 0.8885796697959967 0.8420239034553967 0.8392202068644058 0.7730496593599919 0.7309501910048304 0.6629311225104748 0.5882603074043987 0.5331245057585382 0.49233054665408593 0.43613165072503346 0.015485365969729223 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.013691619059957128 0.7520571701150119 0.7861418383783155 0.8241049943177475 0.8624346662885827 0.9013282822657565 0.9283071418464753 0.8896912994758494 0.9621661369055691 0.9610393539205773 0.9724696788380245 0.9268308327069212 0.8885796697959967 0.8420239034553967 0.8392202068644058 0.7730496593599919 0.7309501910048304 0.6629311225104748 0.5882603074043987 0.5331245057585382 0.49233054665408593 0.43613165072503346 0.015485365969729223 ] } "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" [ "Cu" "Cu" "Cu" "Cu" ] } "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 ] } }