{ "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" 3.518474650382997 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.518474650382997e-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" [ 2.45642191225875 2.20838764528344 2.15492489687814 2.20647613246423 2.23435532267892 2.24651078617234 2.22423358329284 2.19607417047047 2.22241990730906 2.23711170713753 2.19679239032712 2.22639077578793 2.19173730268242 2.24852154722254 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.45642191225875e-10 2.20838764528344e-10 2.15492489687814e-10 2.20647613246423e-10 2.23435532267892e-10 2.24651078617234e-10 2.22423358329284e-10 2.19607417047047e-10 2.22241990730906e-10 2.23711170713753e-10 2.19679239032712e-10 2.22639077578793e-10 2.19173730268242e-10 2.24852154722254e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.020017514874439805 1.0318322762136931 1.1685483818955305 1.2200915031708932 1.1201233034635694 1.0137888208204937 0.5496753610080573 0.9165298504828772 1.0999217194412625 1.3420753190941208 1.3179664801373343 1.2840377578644604 1.281123390034997 1.2754730446849578 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.02001751487443981 1.031832276213693 1.16854838189553 1.220091503170893 1.120123303463569 1.013788820820494 0.5496753610080573 0.9165298504828772 1.099921719441262 1.342075319094121 1.317966480137334 1.28403775786446 1.281123390034997 1.275473044684958 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 3 75 105 165 41 185 33 219 15 293 293 15 437 33 ] } "species" { "source-value" [ "Ni" "Ni" "Ni" "Ni" ] } "tilt-angle" { "source-value" [ 0.0 23.07391806563098 34.04773236999154 38.572650822227786 44.41530859719298 52.20027756457278 62.96430821058772 69.97282751604145 78.46304096718453 88.83061719438597 91.16938280561406 101.5369590328155 110.02717248395858 117.03569178941231 ] "source-unit" "degrees" "si-unit" "radian" "si-value" [ 0.0 0.4027158415806617 0.5942450326942046 0.6732197580699728 0.7751933733103614 0.9110667139567219 1.098934489515255 1.221256227085009 1.369438406004566 1.550386746620723 1.591205906969071 1.772154247585227 1.920336426504785 2.042658164074539 ] } "tilt-axis" { "source-value" [ 1 1 2 ] } }