The structural details of the X4Y2Z compounds with I-42d symmetry

The structural details of the X4Y2Z compounds with I-42d symmetry

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Space Group 97: I422; I 4 2 2

The structural details of the X4Y2Z compounds with I-42d symmetry

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Color online) Formation energies E PBE DFT , F PBE 0 K , F PBE 100 K

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Yi XIA, Assistant Professor, Ph.D, Portland State University, OR, PSU

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The structural details of the X4Y2Z compounds with I-42d symmetry

Unit cell diagrams of CuInSe 2 (I42d) chalcopyrite structure (left) and

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