# Fileset

[W2Zr1_mp_4296181337.dat](https://mdr.nims.go.jp/filesets/b0971dab-3142-4f77-88a3-dffce9f813db/download)

## Creator

Thien Duc Ngo, [Tadaaki Nagao](https://orcid.org/0000-0002-6746-2686)

## Rights

Creative Commons BY Attribution 4.0 International[Creative Commons BY Attribution 4.0 International](https://creativecommons.org/licenses/by/4.0/)

## Other metadata

[First-principles optical properties and thermophotonic device parameters for Zr2W4 / (Fd-3m, #227, Cubic) / AtomWork-Adv Material ID 4296181337](https://mdr.nims.go.jp/datasets/ffd10264-18de-4d2a-9947-5a0de6d0b6a0)

## Fulltext

\# Wavelength(um) Real(xyz) Imag(xyz) 0.2000 -4.9454 9.4235 0.2124 -4.3614 11.8778 0.2248 -2.7483 13.5540 0.2372 -0.4384 14.0158 0.2496 0.4418 12.5763 0.2620 -0.3490 12.4015 0.2744 -0.5507 13.0275 0.2868 -0.4594 13.4279 0.2992 -0.6846 13.6907 0.3116 -1.0044 14.2718 0.3240 -1.1592 14.9683 0.3364 -1.3234 15.4741 0.3488 -1.8910 16.1745 0.3612 -2.2676 17.5495 0.3736 -1.9750 18.9198 0.3860 -1.4368 19.8983 0.3984 -0.9415 20.6201 0.4108 -0.5322 21.1797 0.4232 -0.2824 21.6119 0.4356 -0.2379 22.0406 0.4480 -0.3797 22.5808 0.4604 -0.6443 23.3445 0.4728 -0.8813 24.4305 0.4852 -0.8050 25.8093 0.4976 -0.3473 27.1796 0.5100 0.3542 28.3693 0.5224 1.1783 29.3463 0.5348 1.9974 30.0744 0.5472 2.7518 30.7240 0.5596 3.4713 31.3262 0.5720 4.2246 31.8931 0.5844 4.9788 32.3711 0.5968 5.7326 32.7674 0.6092 6.4224 33.0716 0.6216 7.0646 33.3344 0.6340 7.6532 33.5855 0.6464 8.2027 33.8274 0.6588 8.7492 34.0560 0.6712 9.2774 34.2748 0.6836 9.7863 34.4664 0.6960 10.2827 34.6221 0.7084 10.7499 34.7736 0.7208 11.1825 34.9013 0.7332 11.5878 35.0242 0.7456 11.9750 35.1484 0.7580 12.3679 35.2877 0.7704 12.7364 35.4240 0.7828 13.0936 35.5508 0.7952 13.4793 35.6467 0.8076 13.8415 35.7411 0.8200 14.1810 35.8342 0.8324 14.5107 35.8944 0.8448 14.8208 35.9499 0.8572 15.1101 36.0054 0.8696 15.3906 36.0646 0.8820 15.6974 36.1382 0.8944 15.9840 36.2115 0.9068 16.2510 36.2845 0.9192 16.5116 36.3508 0.9316 16.8617 36.3614 0.9440 17.1933 36.3723 0.9564 17.5046 36.3846 0.9688 17.7962 36.3985 0.9812 18.0867 36.3362 0.9936 18.3795 36.1855 1.0060 18.6533 36.0403 1.0184 18.9087 35.9007 1.0308 19.1463 35.7662 1.0432 19.3484 35.6106 1.0556 19.4664 35.3637 1.0680 19.5696 35.1237 1.0804 19.6588 34.8913 1.0928 19.7342 34.6662 1.1052 19.7963 34.4483 1.1176 19.8254 34.2343 1.1300 19.7689 34.0164 1.1424 19.7019 33.8053 1.1548 19.6247 33.6010 1.1672 19.5375 33.4032 1.1796 19.4406 33.2117 1.1920 19.3341 33.0264 1.2044 19.2049 32.8530 1.2168 19.0364 32.6987 1.2292 18.8597 32.5497 1.2416 18.6749 32.4062 1.2540 18.4822 32.2677 1.2664 18.2817 32.1344 1.2788 18.0734 32.0060 1.2912 17.8577 31.8824 1.3036 17.6326 31.7684 1.3160 17.3945 31.6741 1.3284 17.1493 31.5841 1.3408 16.8971 31.4981 1.3532 16.6380 31.4163 1.3656 16.3721 31.3385 1.3780 16.0993 31.2647 1.3904 15.8200 31.1948 1.4028 15.5341 31.1287 1.4152 15.2417 31.0664 1.4276 14.9473 31.0037 1.4400 14.6485 30.9428 1.4524 14.3433 30.8857 1.4648 14.0319 30.8322 1.4772 13.7143 30.7823 1.4896 13.3905 30.7360 1.5020 13.0605 30.6934 1.5144 12.7246 30.6542 1.5268 12.3829 30.6183 1.5392 12.0348 30.5861 1.5516 11.6812 30.5572 1.5640 11.3170 30.5266 1.5764 10.9366 30.4886 1.5888 10.5502 30.4531 1.6012 10.1581 30.4214 1.6136 9.7610 30.3929 1.6260 9.3583 30.3680 1.6384 8.9506 30.3464 1.6508 8.5375 30.3283 1.6632 8.1193 30.3134 1.6756 7.6962 30.3017 1.6880 7.2675 30.2936 1.7004 6.8341 30.2885 1.7128 6.3959 30.2866 1.7252 5.9522 30.2881 1.7376 5.4950 30.2961 1.7500 5.0190 30.3125 1.7624 4.5362 30.3329 1.7748 4.0488 30.3563 1.7872 3.5570 30.3826 1.7996 3.0609 30.4117 1.8120 2.5605 30.4437 1.8244 2.0554 30.4787 1.8368 1.5459 30.5167 1.8492 1.0321 30.5575 1.8616 0.5140 30.6011 1.8740 -0.0083 30.6475 1.8864 -0.5349 30.6967 1.8988 -1.0657 30.7488 1.9112 -1.6008 30.8036 1.9236 -2.1401 30.8612 1.9360 -2.6835 30.9216 1.9484 -3.2312 30.9848 1.9608 -3.7883 31.0710 1.9732 -4.3509 31.1651 1.9856 -4.9176 31.2619 1.9980 -5.4883 31.3612 2.0104 -6.0631 31.4629 2.0228 -6.6418 31.5670 2.0352 -7.2245 31.6735 2.0476 -7.8112 31.7824 2.0600 -8.4017 31.8937 2.0724 -8.9961 32.0074 2.0848 -9.5944 32.1234 2.0972 -10.1965 32.2418 2.1096 -10.8023 32.3626 2.1220 -11.4123 32.4858 2.1344 -12.0263 32.6117 2.1468 -12.6441 32.7399 2.1592 -13.2655 32.8704 2.1716 -13.8906 33.0032 2.1840 -14.5192 33.1382 2.1964 -15.1521 33.2760 2.2088 -15.7889 33.4163 2.2212 -16.4292 33.5588 2.2336 -17.0681 33.7104 2.2460 -17.6990 33.8802 2.2584 -18.3350 34.0529 2.2708 -18.9744 34.2275 2.2832 -19.6172 34.4041 2.2956 -20.2634 34.5826 2.3080 -20.9148 34.7639 2.3204 -21.5693 34.9472 2.3328 -22.2270 35.1323 2.3452 -22.8891 35.3199 2.3576 -23.5552 35.5099 2.3700 -24.2244 35.7017 2.3824 -24.8972 35.8957 2.3948 -25.5746 36.0925 2.4072 -26.2549 36.2910 2.4196 -26.9387 36.4916 2.4320 -27.6272 36.6951 2.4444 -28.3182 36.9002 2.4568 -29.0132 37.1077 2.4692 -29.7124 37.3178 2.4816 -30.4139 37.5294 2.4940 -31.1203 37.7441 2.5064 -31.8298 37.9608 2.5188 -32.5420 38.1791 2.5312 -33.2594 38.4009 2.5436 -33.9788 38.6240 2.5560 -34.7027 38.8499 2.5684 -35.4298 39.0780 2.5808 -36.1596 39.3080 2.5932 -36.8916 39.5418 2.6056 -37.6231 39.7771 2.6180 -38.3425 40.0202 2.6304 -39.0638 40.2645 2.6428 -39.7898 40.5117 2.6552 -40.5189 40.7609 2.6676 -41.2514 41.0123 2.6800 -41.9882 41.2665 2.6924 -42.7273 41.5221 2.7048 -43.4716 41.7812 2.7172 -44.2174 42.0412 2.7296 -44.9690 42.3052 2.7420 -45.7216 42.5697 2.7544 -46.4804 42.8385 2.7668 -47.2398 43.1076 2.7792 -48.0057 43.3811 2.7916 -48.7719 43.6550 2.8040 -49.5447 43.9333 2.8164 -50.3179 44.2119 2.8288 -51.0973 44.4949 2.8412 -51.8774 44.7784 2.8536 -52.6633 45.0660 2.8660 -53.4506 45.3546 2.8784 -54.2427 45.6466 2.8908 -55.0371 45.9404 2.9032 -55.8352 46.2368 2.9156 -56.6368 46.5358 2.9280 -57.4406 46.8365 2.9404 -58.2495 47.1409 2.9528 -59.0588 47.4457 2.9652 -59.8750 47.7556 2.9776 -60.6912 48.0656 2.9900 -61.5132 48.3800 3.0024 -62.3368 48.6956 3.0148 -63.1637 49.0138 3.0272 -63.9948 49.3353 3.0396 -64.8263 49.6571 3.0520 -65.6650 49.9846 3.0644 -66.5036 50.3120 3.0768 -67.3471 50.6433 3.0892 -68.1933 50.9769 3.1016 -69.0400 51.3114 3.1140 -69.8890 51.6507 3.1264 -70.7379 51.9901 3.1388 -71.5837 52.3328 3.1512 -72.4277 52.6774 3.1636 -73.2721 53.0223 3.1760 -74.1243 53.3736 3.1884 -74.9765 53.7248 3.2008 -75.8322 54.0790 3.2132 -76.6926 54.4370 3.2256 -77.5530 54.7951 3.2380 -78.4197 55.1583 3.2504 -79.2884 55.5234 3.2628 -80.1572 55.8884 3.2752 -81.0344 56.2607 3.2876 -81.9116 56.6329 3.3000 -82.7905 57.0066 3.3124 -83.6761 57.3862 3.3248 -84.5618 57.7658 3.3372 -85.4504 58.1480 3.3496 -86.3446 58.5352 3.3620 -87.2388 58.9224 3.3744 -88.1366 59.3129 3.3868 -89.0394 59.7078 3.3992 -89.9422 60.1027 3.4116 -90.8489 60.5012 3.4240 -91.7604 60.9041 3.4364 -92.6718 61.3071 3.4488 -93.5867 61.7132 3.4612 -94.5070 62.1244 3.4736 -95.4272 62.5355 3.4860 -96.3499 62.9489 3.4984 -97.2789 63.3685 3.5108 -98.2080 63.7881 3.5232 -99.1378 64.2084 3.5356 -100.0757 64.6366 3.5480 -101.0137 65.0649 3.5604 -101.9517 65.4932 3.5728 -102.8969 65.9287 3.5852 -103.8439 66.3659 3.5976 -104.7908 66.8031 3.6100 -105.7420 67.2446 3.6224 -106.6980 67.6910 3.6348 -107.6540 68.1374 3.6472 -108.6104 68.5842 3.6596 -109.5755 69.0400 3.6720 -110.5406 69.4958 3.6844 -111.5056 69.9517 3.6968 -112.4758 70.4128 3.7092 -113.4500 70.8784 3.7216 -114.4242 71.3439 3.7340 -115.3985 71.8094 3.7464 -116.3816 72.2846 3.7588 -117.3651 72.7602 3.7712 -118.3486 73.2357 3.7836 -119.3347 73.7142 3.7960 -120.3275 74.2001 3.8084 -121.3202 74.6859 3.8208 -122.3130 75.1717 3.8332 -123.3107 75.6632 3.8456 -124.3128 76.1596 3.8580 -125.3149 76.6560 3.8704 -126.3170 77.1525 3.8828 -127.3203 77.6548 3.8952 -128.3242 78.1600 3.9076 -129.3281 78.6652 3.9200 -130.3321 79.1704 3.9324 -131.3357 79.6817 3.9448 -132.3392 80.1954 3.9572 -133.3427 80.7091 3.9696 -134.3463 81.2228 3.9820 -135.3564 81.7442 3.9944 -136.3698 82.2696 4.0068 -137.3833 82.7950 4.0192 -138.3968 83.3204 4.0316 -139.4152 83.8517 4.0440 -140.4387 84.3892 4.0564 -141.4621 84.9267 4.0688 -142.4856 85.4641 4.0812 -143.5113 86.0044 4.0936 -144.5448 86.5543 4.1060 -145.5783 87.1042 4.1184 -146.6118 87.6541 4.1308 -147.6453 88.2039 4.1432 -148.6872 88.7646 4.1556 -149.7308 89.3273 4.1680 -150.7743 89.8900 4.1804 -151.8179 90.4527 4.1928 -152.8648 91.0198 4.2052 -153.9184 91.5957 4.2176 -154.9720 92.1716 4.2300 -156.0257 92.7475 4.2424 -157.0793 93.3235 4.2548 -158.1401 93.9090 4.2672 -159.2038 94.4985 4.2796 -160.2675 95.0880 4.2920 -161.3313 95.6776 4.3044 -162.3950 96.2671 4.3168 -163.4683 96.8700 4.3292 -164.5422 97.4735 4.3416 -165.6160 98.0771 4.3540 -166.6899 98.6806 4.3664 -167.7643 99.2851 4.3788 -168.8483 99.9031 4.3912 -169.9323 100.5212 4.4036 -171.0162 101.1392 4.4160 -172.1002 101.7572 4.4284 -173.1845 102.3758 4.4408 -174.2785 103.0087 4.4532 -175.3726 103.6417 4.4656 -176.4667 104.2747 4.4780 -177.5608 104.9077 4.4904 -178.6549 105.5406 4.5028 -179.7576 106.1868 4.5152 -180.8618 106.8352 4.5276 -181.9659 107.4836 4.5400 -183.0701 108.1320 4.5524 -184.1743 108.7804 4.5648 -185.2838 109.4372 4.5772 -186.3981 110.1015 4.5896 -187.5123 110.7658 4.6020 -188.6266 111.4301 4.6144 -189.7409 112.0944 4.6268 -190.8556 112.7594 4.6392 -191.9799 113.4401 4.6516 -193.1042 114.1208 4.6640 -194.2285 114.8015 4.6764 -195.3528 115.4823 4.6888 -196.4771 116.1630 4.7012 -197.6053 116.8503 4.7136 -198.7396 117.5480 4.7260 -199.8739 118.2456 4.7384 -201.0082 118.9433 4.7508 -202.1425 119.6410 4.7632 -203.2768 120.3386 4.7756 -204.4167 121.0462 4.7880 -205.5610 121.7613 4.8004 -206.7052 122.4765 4.8128 -207.8495 123.1917 4.8252 -208.9937 123.9069 4.8376 -210.1380 124.6220 4.8500 -211.2877 125.3472 4.8624 -212.4418 126.0805 4.8748 -213.5959 126.8137 4.8872 -214.7500 127.5470 4.8996 -215.9041 128.2802 4.9120 -217.0582 129.0135 4.9244 -218.2158 129.7533 4.9368 -219.3797 130.5053 4.9492 -220.5436 131.2572 4.9616 -221.7075 132.0091 4.9740 -222.8713 132.7610 4.9864 -224.0352 133.5129 4.9988 -225.1991 134.2649 5.0112 -226.3722 135.0352 5.0236 -227.5457 135.8064 5.0360 -228.7193 136.5776 5.0484 -229.8928 137.3488 5.0608 -231.0664 138.1200 5.0732 -232.2399 138.8912 5.0856 -233.4167 139.6693 5.0980 -234.5998 140.4605 5.1104 -235.7829 141.2516 5.1228 -236.9659 142.0427 5.1352 -238.1490 142.8339 5.1476 -239.3321 143.6250 5.1600 -240.5151 144.4161 5.1724 -241.6990 145.2140 5.1848 -242.8835 146.0182 5.1972 -244.0681 146.8223 5.2096 -245.2527 147.6265 5.2220 -246.4372 148.4307 5.2344 -247.6218 149.2348 5.2468 -248.8064 150.0390 5.2592 -249.9927 150.8505 5.2716 -251.1811 151.6708 5.2840 -252.3695 152.4911 5.2964 -253.5579 153.3114 5.3088 -254.7463 154.1317 5.3212 -255.9347 154.9519 5.3336 -257.1231 155.7722 5.3460 -258.3129 156.5959 5.3584 -259.5107 157.4386 5.3708 -260.7085 158.2813 5.3832 -261.9064 159.1240 5.3956 -263.1042 159.9667 5.4080 -264.3021 160.8094 5.4204 -265.4999 161.6521 5.4328 -266.6977 162.4948 5.4452 -267.9010 163.3512 5.4576 -269.1080 164.2170 5.4700 -270.3151 165.0829 5.4824 -271.5221 165.9487 5.4948 -272.7292 166.8146 5.5072 -273.9362 167.6804 5.5196 -275.1432 168.5463 5.5320 -276.3503 169.4121 5.5444 -277.5641 170.2961 5.5568 -278.7801 171.1858 5.5692 -279.9960 172.0755 5.5816 -281.2120 172.9653 5.5940 -282.4280 173.8550 5.6064 -283.6439 174.7448 5.6188 -284.8599 175.6345 5.6312 -286.0759 176.5242 5.6436 -287.2974 177.4298 5.6560 -288.5220 178.3442 5.6684 -289.7466 179.2587 5.6808 -290.9712 180.1731 5.6932 -292.1957 181.0875 5.7056 -293.4203 182.0019 5.7180 -294.6449 182.9163 5.7304 -295.8695 183.8307 5.7428 -297.0960 184.7509 5.7552 -298.3288 185.6907 5.7676 -299.5617 186.6306 5.7800 -300.7946 187.5705 5.7924 -302.0274 188.5104 5.8048 -303.2603 189.4503 5.8172 -304.4932 190.3901 5.8296 -305.7260 191.3300 5.8420 -306.9589 192.2699 5.8544 -308.1956 193.2227 5.8668 -309.4364 194.1889 5.8792 -310.6772 195.1551 5.8916 -311.9179 196.1213 5.9040 -313.1587 197.0874 5.9164 -314.3994 198.0536 5.9288 -315.6402 199.0198 5.9412 -316.8809 199.9860 5.9536 -318.1217 200.9521 5.9660 -319.3656 201.9298 5.9784 -320.6138 202.9231 5.9908 -321.8620 203.9164 6.0032 -323.1102 204.9097 6.0156 -324.3584 205.9031 6.0280 -325.6066 206.8964 6.0404 -326.8548 207.8897 6.0528 -328.1030 208.8831 6.0652 -329.3512 209.8764 6.0776 -330.5995 210.8697 6.0900 -331.8546 211.8909 6.1024 -333.1098 212.9123 6.1148 -334.3650 213.9336 6.1272 -335.6202 214.9550 6.1396 -336.8754 215.9763 6.1520 -338.1305 216.9977 6.1644 -339.3857 218.0190 6.1768 -340.6409 219.0404 6.1892 -341.8961 220.0617 6.2016 -343.1525 221.0887 6.2140 -344.4141 222.1389 6.2264 -345.6758 223.1892 6.2388 -346.9374 224.2395 6.2512 -348.1990 225.2897 6.2636 -349.4606 226.3400 6.2760 -350.7223 227.3903 6.2884 -351.9839 228.4406 6.3008 -353.2455 229.4908 6.3132 -354.5071 230.5411 6.3256 -355.7688 231.5914 6.3380 -357.0362 232.6712 6.3504 -358.3036 233.7513 6.3628 -359.5711 234.8314 6.3752 -360.8386 235.9115 6.3876 -362.1060 236.9916 6.4000 -363.3735 238.0717 6.4124 -364.6410 239.1518 6.4248 -365.9085 240.2319 6.4372 -367.1759 241.3120 6.4496 -368.4434 242.3922 6.4620 -369.7128 243.4834 6.4744 -370.9854 244.5943 6.4868 -372.2581 245.7052 6.4992 -373.5307 246.8161 6.5116 -374.8034 247.9270 6.5240 -376.0761 249.0379 6.5364 -377.3487 250.1487 6.5488 -378.6214 251.2596 6.5612 -379.8940 252.3705 6.5736 -381.1667 253.4814 6.5860 -382.4394 254.5923 6.5984 -383.7133 255.7122 6.6108 -384.9904 256.8548 6.6232 -386.2675 257.9974 6.6356 -387.5447 259.1400 6.6480 -388.8218 260.2826 6.6604 -390.0989 261.4253 6.6728 -391.3760 262.5679 6.6852 -392.6532 263.7105 6.6976 -393.9303 264.8531 6.7100 -395.2074 265.9958 6.7224 -396.4845 267.1384 6.7348 -397.7617 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