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Crystal structure of Ti 4 Ni 2 C.

Huizi LiuXinyu LiangYibo LiuChangzeng FanBin WenLifeng Zhang
Published in: IUCrData (2024)
Single crystals of the inter-metallic phase with composition Ti 4 Ni 2 C were serendipitously obtained by high-pressure sinter-ing of a mixture with initial chemical composition Ti 2 Ni. The Ti 4 Ni 2 C phase crystallizes in the Fd m space group and can be considered as a partially filled Ti 2 Ni structure with the C atom occupying an octa-hedral void. Ti 4 Ni 2 C is isotypic with Ti 4 Ni 2 O, Nb 4 Ni 2 C and Ta 4 Ni 2 C, all of which were studied previously by means of powder diffraction.
Keyphrases
  • metal organic framework
  • transition metal
  • molecular dynamics