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dft%20calculations
dft%20calculations
https://triplydb.com/EltonPan/MatKGtest/dft%20calculations
dft%20calculations
https://triplydb.com/EltonPan/MatKGtest/dft%20calculations
_CMT_APL_
catalyst
_CMT_CHM_
CO
H
N
carbon
_CMT_CMT_
nmr
_CMT_PRO_
activity
structure