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obtaining hamiltonian matrix
Posted: Sun Oct 23, 2005 9:46 pm
by edurgun
is it possible to obtain matrix elements of hamiltonian which VASP constructs and try to solve? thank you for your help...
obtaining hamiltonian matrix
Posted: Thu Nov 24, 2005 1:37 pm
by admin
no
obtaining hamiltonian matrix
Posted: Thu Jan 20, 2011 4:31 pm
by JSH
Is the answer still ‘no’ in the current version of VASP (5.2.11)? Thanks.
obtaining hamiltonian matrix
Posted: Mon Jan 31, 2011 3:06 pm
by admin
yes
[ Edited Mon Jan 31 2011, 04:07PM ]