2025年12月27日土曜日

MOF

MOF is the metal–organic framework. Chemistry is recently calculating. NM125-TiO2 is the MOF-metal oxide composite material. The sensing ability of NM125-TiO2 for over 100 human-breath compounds spanning 13 different diseases is examined.



gray = carbon, white = hydrogen, red = oxygen, blue = nitrogen



The black line is the DOS which is density of states, the red line is the Gaussian function, and the blue line is the Gaussian-weighted DOS.



The DOS of the NM125-TiO2 structure is calculated.