[
    {
        "property-id" "tag:staff@noreply.openkim.org,2024-07-10:property/elastic-constants-isothermal-npt" 
        "instance-id" 1 
        "prototype-label" {
            "source-value" "A2B_cP12_205_c_a"
        } 
        "stoichiometric-species" {
            "source-value" [
                "O" 
                "Ti"
            ]
        } 
        "a" {
            "source-value" 4.8234 
            "source-unit" "angstrom" 
            "si-unit" "m" 
            "si-value" 4.8234e-10
        } 
        "parameter-names" {
            "source-value" [
                "x2"
            ]
        } 
        "parameter-values" {
            "source-value" [
                0.33753516
            ]
        } 
        "cell-cauchy-stress" {
            "source-value" [
                0.0 
                0.0 
                0.0 
                0.0 
                0.0 
                0.0
            ] 
            "source-unit" "eV/angstrom^3" 
            "si-unit" "kg / m s^2" 
            "si-value" [
                0.0 
                0.0 
                0.0 
                0.0 
                0.0 
                0.0
            ]
        } 
        "temperature" {
            "source-value" 0.0 
            "source-unit" "K" 
            "si-unit" "K" 
            "si-value" 0.0
        } 
        "coordinates-file" {
            "source-value" "instance-1.poscar"
        } 
        "crystal-genome-source-structure-id" {
            "source-value" [
                "TE_563391191708_002-and-SM_690504433912_000-1711749036-tr:2"
            ]
        } 
        "elastic-constants-names" {
            "source-value" [
                "c11" 
                "c12" 
                "c44"
            ]
        } 
        "elastic-constants-values" {
            "source-value" [
                453.87406732497357 
                162.39565452723997 
                140.00737951373625
            ] 
            "source-unit" "GPa" 
            "source-expand-uncert-value" [
                0.29717517999753146 
                0.8116072080739403 
                0.1268102307541219
            ] 
            "uncert-lev-of-confid" 95.0 
            "si-unit" "kg / m s^2" 
            "si-value" [
                453874067324.9736 
                162395654527.24 
                140007379513.7363
            ]
        } 
        "elasticity-matrix-raw" {
            "source-value" [
                [
                    453.87406732497357 
                    162.39565452723997 
                    161.68998911918803 
                    -0.020783046388250334 
                    0.006520371968645173 
                    0.0006748257891285173
                ] 
                [
                    162.39565452723997 
                    454.34755998571586 
                    163.0505032293818 
                    0.01285004359634176 
                    0.002500532354418776 
                    0.008224404290777306
                ] 
                [
                    161.68998911918803 
                    163.0505032293818 
                    452.68122348931087 
                    0.007657418337261225 
                    0.0012365737737233126 
                    0.005534024122055459
                ] 
                [
                    -0.020783046388250334 
                    0.01285004359634176 
                    0.007657418337261225 
                    140.00737951373625 
                    -0.0017334114579835352 
                    -2.915820794083533e-05
                ] 
                [
                    0.006520371968645173 
                    0.002500532354418776 
                    0.0012365737737233126 
                    -0.0017334114579835352 
                    139.96564221605755 
                    -0.00024121797757431314
                ] 
                [
                    0.0006748257891285173 
                    0.008224404290777306 
                    0.005534024122055459 
                    -2.915820794083533e-05 
                    -0.00024121797757431314 
                    139.93385269868094
                ]
            ] 
            "source-unit" "GPa" 
            "source-expand-uncert-value" [
                [
                    0.29717517999753146 
                    0.8116072080739403 
                    0.8948896339137551 
                    0.05683273257266509 
                    0.052038762730308705 
                    0.0607217844890487
                ] 
                [
                    0.8116072080739403 
                    0.6963862774219446 
                    1.1092958683611998 
                    0.07050744843065482 
                    0.07830729501681764 
                    0.05455930158370401
                ] 
                [
                    0.8948896339137551 
                    1.1092958683611998 
                    1.4698117588155941 
                    0.018398519698679887 
                    0.19958348949536397 
                    0.10877207588213039
                ] 
                [
                    0.05683273257266509 
                    0.07050744843065482 
                    0.018398519698679887 
                    0.1268102307541219 
                    0.005318912432749523 
                    0.0003408590367673801
                ] 
                [
                    0.052038762730308705 
                    0.07830729501681764 
                    0.19958348949536397 
                    0.005318912432749523 
                    0.31555794294967116 
                    0.0050494091787426885
                ] 
                [
                    0.0607217844890487 
                    0.05455930158370401 
                    0.10877207588213039 
                    0.0003408590367673801 
                    0.0050494091787426885 
                    0.0674224693834797
                ]
            ] 
            "uncert-lev-of-confid" 95.0 
            "si-unit" "kg / m s^2" 
            "si-value" [
                [
                    453874067324.9736 
                    162395654527.24 
                    161689989119.188 
                    -20783046.38825033 
                    6520371.968645173 
                    674825.7891285173
                ] 
                [
                    162395654527.24 
                    454347559985.7159 
                    163050503229.3818 
                    12850043.59634176 
                    2500532.354418776 
                    8224404.290777306
                ] 
                [
                    161689989119.188 
                    163050503229.3818 
                    452681223489.3109 
                    7657418.337261225 
                    1236573.773723313 
                    5534024.122055459
                ] 
                [
                    -20783046.38825033 
                    12850043.59634176 
                    7657418.337261225 
                    140007379513.7363 
                    -1733411.457983535 
                    -29158.20794083533
                ] 
                [
                    6520371.968645173 
                    2500532.354418776 
                    1236573.773723313 
                    -1733411.457983535 
                    139965642216.0576 
                    -241217.9775743131
                ] 
                [
                    674825.7891285173 
                    8224404.290777306 
                    5534024.122055459 
                    -29158.20794083533 
                    -241217.9775743131 
                    139933852698.6809
                ]
            ]
        } 
        "elasticity-matrix" {
            "source-value" [
                [
                    2.8328591332105746 
                    1.013593959735553 
                    1.013593959735553 
                    0.0 
                    0.0 
                    0.0
                ] 
                [
                    1.013593959735553 
                    2.8328591332105746 
                    1.013593959735553 
                    0.0 
                    0.0 
                    0.0
                ] 
                [
                    1.013593959735553 
                    1.013593959735553 
                    2.8328591332105746 
                    0.0 
                    0.0 
                    0.0
                ] 
                [
                    0.0 
                    0.0 
                    0.0 
                    0.8738573369259856 
                    0.0 
                    0.0
                ] 
                [
                    0.0 
                    0.0 
                    0.0 
                    0.0 
                    0.8738573369259856 
                    0.0
                ] 
                [
                    0.0 
                    0.0 
                    0.0 
                    0.0 
                    0.0 
                    0.8738573369259856
                ]
            ] 
            "source-unit" "GPa" 
            "si-unit" "kg / m s^2" 
            "si-value" [
                [
                    2832859133.210575 
                    1013593959.735553 
                    1013593959.735553 
                    0.0 
                    0.0 
                    0.0
                ] 
                [
                    1013593959.735553 
                    2832859133.210575 
                    1013593959.735553 
                    0.0 
                    0.0 
                    0.0
                ] 
                [
                    1013593959.735553 
                    1013593959.735553 
                    2832859133.210575 
                    0.0 
                    0.0 
                    0.0
                ] 
                [
                    0.0 
                    0.0 
                    0.0 
                    873857336.9259856 
                    0.0 
                    0.0
                ] 
                [
                    0.0 
                    0.0 
                    0.0 
                    0.0 
                    873857336.9259856 
                    0.0
                ] 
                [
                    0.0 
                    0.0 
                    0.0 
                    0.0 
                    0.0 
                    873857336.9259856
                ]
            ]
        } 
        "distance-to-isotropy" {
            "source-value" 0.04368025341169641
        }
    } 
    {
        "property-id" "tag:staff@noreply.openkim.org,2024-07-10:property/bulk-modulus-isothermal-npt" 
        "instance-id" 2 
        "prototype-label" {
            "source-value" "A2B_cP12_205_c_a"
        } 
        "stoichiometric-species" {
            "source-value" [
                "O" 
                "Ti"
            ]
        } 
        "a" {
            "source-value" 4.8234 
            "source-unit" "angstrom" 
            "si-unit" "m" 
            "si-value" 4.8234e-10
        } 
        "parameter-names" {
            "source-value" [
                "x2"
            ]
        } 
        "parameter-values" {
            "source-value" [
                0.33753516
            ]
        } 
        "cell-cauchy-stress" {
            "source-value" [
                0.0 
                0.0 
                0.0 
                0.0 
                0.0 
                0.0
            ] 
            "source-unit" "eV/angstrom^3" 
            "si-unit" "kg / m s^2" 
            "si-value" [
                0.0 
                0.0 
                0.0 
                0.0 
                0.0 
                0.0
            ]
        } 
        "temperature" {
            "source-value" 0.0 
            "source-unit" "K" 
            "si-unit" "K" 
            "si-value" 0.0
        } 
        "coordinates-file" {
            "source-value" "instance-2.poscar"
        } 
        "crystal-genome-source-structure-id" {
            "source-value" [
                "TE_563391191708_002-and-SM_690504433912_000-1711749036-tr:2"
            ]
        } 
        "isothermal-bulk-modulus" {
            "source-value" 259.46272223573965 
            "source-unit" "GPa" 
            "si-unit" "kg / m s^2" 
            "si-value" 259462722235.7397
        }
    }
]