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plutotoday銀蟲 (小有名氣)
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[求助]
求大神幫忙解個晶體,實(shí)在解不出了! 已有1人參與
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| 剛學(xué)解晶體,這個實(shí)在不會解了,哪位幫我解解看吧謝謝了!結(jié)構(gòu)有可能是圖畫的這樣。第二個壓縮包 |
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TITL a in Fdd2 CELL 0.71073 14.7858 28.8686 9.8661 90.000 90.000 90.000 ZERR 8.00 0.0007 0.0016 0.0005 0.000 0.000 0.000 LATT -4 SYMM -X, -Y, Z SYMM 0.25+X, 0.25-Y, 0.25+Z SYMM 0.25-X, 0.25+Y, 0.25+Z SFAC C H N CL AG UNIT 168 192 16 8 8 L.S. 10 BOND $H FMAP 2 PLAN 20 OMIT -4 56 ACTA CONF WGHT 0.031600 1.419100 FVAR 0.04710 AG1 5 0.500000 0.500000 0.406149 10.50000 0.04915 0.05991 = 0.02798 0.00000 0.00000 -0.00441 CL1 4 0.500000 0.500000 0.173103 10.50000 0.07024 0.09246 = 0.02711 0.00000 0.00000 0.00577 N1 3 0.557172 0.522667 0.698172 11.00000 0.04482 0.05080 = 0.02881 -0.00281 -0.00160 -0.00660 C1 1 0.631382 0.550046 0.648412 11.00000 0.04355 0.05098 = 0.03380 -0.00294 -0.00131 -0.00606 C2 1 0.714073 0.528464 0.625819 11.00000 0.04798 0.05061 = 0.05463 -0.00171 0.00048 0.00072 C3 1 0.782507 0.555074 0.567639 11.00000 0.04289 0.06556 = 0.06493 -0.00329 0.00578 0.00021 AFIX 43 H3A 2 0.838960 0.541699 0.553642 11.00000 -1.20000 AFIX 0 C4 1 0.769334 0.600147 0.530532 11.00000 0.05348 0.06628 = 0.05575 -0.00071 0.00602 -0.01219 C5 1 0.686354 0.620836 0.557956 11.00000 0.05996 0.05237 = 0.05737 0.00561 -0.00016 -0.00221 AFIX 43 H5A 2 0.677768 0.651879 0.536303 11.00000 -1.20000 AFIX 0 C6 1 0.616743 0.596351 0.616415 11.00000 0.04584 0.05475 = 0.03979 -0.00041 -0.00004 0.00141 C7 1 0.730390 0.478310 0.663772 11.00000 0.07548 0.05588 = 0.11634 0.00690 0.01824 0.01596 AFIX 137 H7A 2 0.713562 0.473488 0.756684 11.00000 -1.50000 H7B 2 0.793277 0.471053 0.652162 11.00000 -1.50000 H7C 2 0.694672 0.458604 0.606519 11.00000 -1.50000 AFIX 0 C8 1 0.844231 0.627298 0.462093 11.00000 0.06967 0.10080 = 0.09991 0.01534 0.02321 -0.01956 AFIX 33 H8A 2 0.823528 0.658148 0.443197 11.00000 -1.50000 H8B 2 0.895898 0.628651 0.520885 11.00000 -1.50000 H8C 2 0.860711 0.612295 0.378842 11.00000 -1.50000 AFIX 0 C9 1 0.527679 0.619601 0.646811 11.00000 0.05722 0.06425 = 0.07633 0.00723 0.00607 0.01144 AFIX 137 H9A 2 0.478948 0.599760 0.619173 11.00000 -1.50000 H9B 2 0.524136 0.648362 0.598257 11.00000 -1.50000 H9C 2 0.523262 0.625481 0.742352 11.00000 -1.50000 AFIX 0 C10 1 0.536275 0.514143 0.832328 11.00000 0.05945 0.06556 = 0.03087 -0.00124 -0.00565 -0.00812 AFIX 43 H10A 2 0.566382 0.525667 0.907909 11.00000 -1.20000 AFIX 0 C11 1 0.500000 0.500000 0.615048 10.50000 0.03417 0.03887 = 0.03557 0.00000 0.00000 -0.00277 HKLF 4 |
銀蟲 (小有名氣)
銀蟲 (小有名氣)
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