High level ab initio and DFT calculations of models of the catalytically active Ni-Fe hydrogenases

Prabha Jayapal, David Robinson, Mahesh Sundararajan, Ian H. Hillier, Joseph J W McDouall

    Research output: Contribution to journalArticlepeer-review

    Fingerprint

    Dive into the research topics of 'High level ab initio and DFT calculations of models of the catalytically active Ni-Fe hydrogenases'. Together they form a unique fingerprint.

    Chemistry