{
    "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-rhombohedral-crystal-npt"
    "instance-id" 1
    "space-group" {
        "source-value" "R3c"
    }
    "basis-atom-coordinates" {
        "source-value" [
            [
                0.843236
                0.699258
                0.925481
            ]
            [
                0.634075
                0.823431
                0.092147
            ]
            [
                0.176569
                0.810644
                0.092147
            ]
            [
                0.189356
                0.365925
                0.092147
            ]
            [
                0.856023
                0.156764
                0.925481
            ]
            [
                0.300742
                0.143977
                0.925481
            ]
            [
                0.509902
                0.032592
                0.258814
            ]
            [
                0.300742
                0.156764
                0.425481
            ]
            [
                0.843236
                0.143977
                0.425481
            ]
            [
                0.856023
                0.699258
                0.425481
            ]
            [
                0.522689
                0.490098
                0.258814
            ]
            [
                0.967408
                0.477311
                0.258814
            ]
            [
                0.176569
                0.365925
                0.592147
            ]
            [
                0.967408
                0.490098
                0.758814
            ]
            [
                0.509902
                0.477311
                0.758814
            ]
            [
                0.522689
                0.032592
                0.758814
            ]
            [
                0.189356
                0.823431
                0.592147
            ]
            [
                0.634075
                0.810644
                0.592147
            ]
            [
                0.003442
                0.758221
                0.749101
            ]
            [
                0.003442
                0.245221
                0.249101
            ]
            [
                0.241779
                0.996558
                0.249101
            ]
            [
                0.754779
                0.758221
                0.249101
            ]
            [
                0.241779
                0.245221
                0.749101
            ]
            [
                0.754779
                0.996558
                0.749101
            ]
            [
                0.670109
                0.091555
                0.082434
            ]
            [
                0.670109
                0.578555
                0.582434
            ]
            [
                0.908445
                0.329891
                0.582434
            ]
            [
                0.421445
                0.091555
                0.582434
            ]
            [
                0.908445
                0.578555
                0.082434
            ]
            [
                0.421445
                0.329891
                0.082434
            ]
            [
                0.336776
                0.424888
                0.415767
            ]
            [
                0.336776
                0.911888
                0.915767
            ]
            [
                0.575112
                0.663224
                0.915767
            ]
            [
                0.088112
                0.424888
                0.915767
            ]
            [
                0.575112
                0.911888
                0.415767
            ]
            [
                0.088112
                0.663224
                0.415767
            ]
            [
                0.40998
                0.073756
                0.082895
            ]
            [
                0.592911
                0.923353
                0.916228
            ]
            [
                0.076647
                0.669557
                0.916228
            ]
            [
                0.330443
                0.407089
                0.916228
            ]
            [
                0.663776
                0.59002
                0.082895
            ]
            [
                0.926244
                0.336224
                0.082895
            ]
            [
                0.076647
                0.407089
                0.416228
            ]
            [
                0.259577
                0.256687
                0.249562
            ]
            [
                0.743313
                0.00289
                0.249562
            ]
            [
                0.99711
                0.740423
                0.249562
            ]
            [
                0.330443
                0.923353
                0.416228
            ]
            [
                0.592911
                0.669557
                0.416228
            ]
            [
                0.743313
                0.740423
                0.749562
            ]
            [
                0.926244
                0.59002
                0.582895
            ]
            [
                0.40998
                0.336224
                0.582895
            ]
            [
                0.663776
                0.073756
                0.582895
            ]
            [
                0.99711
                0.256687
                0.749562
            ]
            [
                0.259577
                0.00289
                0.749562
            ]
            [
                0.619325
                0.942532
                0.021965
            ]
            [
                0.322936
                0.940691
                0.03583
            ]
            [
                0.724135
                0.714008
                0.855298
            ]
            [
                0.199831
                0.113171
                0.228005
            ]
            [
                0.989603
                0.715578
                0.869163
            ]
            [
                0.886829
                0.086661
                0.228005
            ]
            [
                0.69933
                0.86538
                0.211692
            ]
            [
                0.057468
                0.676794
                0.021965
            ]
            [
                0.617755
                0.677064
                0.03583
            ]
            [
                0.13462
                0.83395
                0.211692
            ]
            [
                0.801287
                0.634004
                0.045025
            ]
            [
                0.913339
                0.800169
                0.228005
            ]
            [
                0.989873
                0.275865
                0.855298
            ]
            [
                0.284422
                0.274024
                0.869163
            ]
            [
                0.913339
                0.113171
                0.728005
            ]
            [
                0.323206
                0.380675
                0.021965
            ]
            [
                0.199831
                0.086661
                0.728005
            ]
            [
                0.059309
                0.382245
                0.03583
            ]
            [
                0.832717
                0.198713
                0.045025
            ]
            [
                0.285992
                0.010127
                0.855298
            ]
            [
                0.365996
                0.167283
                0.045025
            ]
            [
                0.725976
                0.010397
                0.869163
            ]
            [
                0.886829
                0.800169
                0.728005
            ]
            [
                0.16605
                0.30067
                0.211692
            ]
            [
                0.285992
                0.275865
                0.355298
            ]
            [
                0.989603
                0.274024
                0.369163
            ]
            [
                0.390802
                0.047341
                0.188631
            ]
            [
                0.866498
                0.446504
                0.561338
            ]
            [
                0.656269
                0.048912
                0.202496
            ]
            [
                0.553496
                0.419994
                0.561338
            ]
            [
                0.365996
                0.198713
                0.545025
            ]
            [
                0.724135
                0.010127
                0.355298
            ]
            [
                0.284422
                0.010397
                0.369163
            ]
            [
                0.801287
                0.167283
                0.545025
            ]
            [
                0.467953
                0.967337
                0.378359
            ]
            [
                0.580006
                0.133502
                0.561338
            ]
            [
                0.65654
                0.609198
                0.188631
            ]
            [
                0.951088
                0.607358
                0.202496
            ]
            [
                0.580006
                0.446504
                0.061338
            ]
            [
                0.989873
                0.714008
                0.355298
            ]
            [
                0.866498
                0.419994
                0.061338
            ]
            [
                0.725976
                0.715578
                0.369163
            ]
            [
                0.499384
                0.532047
                0.378359
            ]
            [
                0.952659
                0.34346
                0.188631
            ]
            [
                0.032663
                0.500616
                0.378359
            ]
            [
                0.392642
                0.343731
                0.202496
            ]
            [
                0.553496
                0.133502
                0.061338
            ]
            [
                0.832717
                0.634004
                0.545025
            ]
            [
                0.952659
                0.609198
                0.688631
            ]
            [
                0.656269
                0.607358
                0.702496
            ]
            [
                0.057468
                0.380675
                0.521965
            ]
            [
                0.533165
                0.779837
                0.894671
            ]
            [
                0.322936
                0.382245
                0.53583
            ]
            [
                0.220163
                0.753328
                0.894671
            ]
            [
                0.032663
                0.532047
                0.878359
            ]
            [
                0.390802
                0.34346
                0.688631
            ]
            [
                0.951088
                0.343731
                0.702496
            ]
            [
                0.467953
                0.500616
                0.878359
            ]
            [
                0.13462
                0.30067
                0.711692
            ]
            [
                0.246672
                0.466835
                0.894671
            ]
            [
                0.323206
                0.942532
                0.521965
            ]
            [
                0.617755
                0.940691
                0.53583
            ]
            [
                0.246672
                0.779837
                0.394671
            ]
            [
                0.65654
                0.047341
                0.688631
            ]
            [
                0.533165
                0.753328
                0.394671
            ]
            [
                0.392642
                0.048912
                0.702496
            ]
            [
                0.16605
                0.86538
                0.711692
            ]
            [
                0.619325
                0.676794
                0.521965
            ]
            [
                0.69933
                0.83395
                0.711692
            ]
            [
                0.059309
                0.677064
                0.53583
            ]
            [
                0.220163
                0.466835
                0.394671
            ]
            [
                0.499384
                0.967337
                0.878359
            ]
        ]
    }
    "species" {
        "source-value" [
            "Li"
            "Li"
            "Li"
            "Li"
            "Li"
            "Li"
            "Li"
            "Li"
            "Li"
            "Li"
            "Li"
            "Li"
            "Li"
            "Li"
            "Li"
            "Li"
            "Li"
            "Li"
            "Fe"
            "Fe"
            "Fe"
            "Fe"
            "Fe"
            "Fe"
            "Fe"
            "Fe"
            "Fe"
            "Fe"
            "Fe"
            "Fe"
            "Fe"
            "Fe"
            "Fe"
            "Fe"
            "Fe"
            "Fe"
            "Si"
            "Si"
            "Si"
            "Si"
            "Si"
            "Si"
            "Si"
            "Si"
            "Si"
            "Si"
            "Si"
            "Si"
            "Si"
            "Si"
            "Si"
            "Si"
            "Si"
            "Si"
            "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"
            "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" 12.75299608
        "source-unit" "angstrom"
    }
    "alpha" {
        "source-value" 90
        "source-unit" "degree"
    }
}