PDF-polarised calculations
SO
celsa-spraggs
Published 2015-09-27 | 5614 Views
1
Lecture 10
1
Spin 2
Geometry optimisation
C K Skylaris
CHEM6085 Density Functional Theory
CHEM6085 Density Functional Theory
2
Unpaired electrons
x2022
So
far
we
have
developed
Kohn
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