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A different implementation of the Monte Carlo projector method is presented.
Finally, I should mention that in addition to the variational methods and method of hyperbolic operator, other methods were developed: other Tauberian methods (like the method of the heat equation or the method of resolvent) and the almost-spectral projector method [33].
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An ultimate acceleration of the classical alternating projectors method is proposed.
Blöchl, P. E. Projector augmented-wave method.
Blöchl, P. E. et al. Projector augmented-wave method.
Kresse, G. & Joubert, D. From ultrasoft pseudopotentials to the projector augmented-wave method.
Kresse, G. & Joubert, D., From ultrasoft pseudopotentials to the projector augmented-wave method.
All calculations were performed using density functional theory and the plane-wave projector augmented-wave65 method as implemented in the VASP code66.
Spin-polarized density functional band-structure calculations using the projector augmented wave method have been carried out for the stable binary compounds in the Si V system.
The strengths were calculated using the Projector Augmented Wave Method within the framework of density functional theory and the generalized gradient approximation.
All of the calculations, including geometry relaxation and electronic structure calculations, are performed using the projector augmented wave method with a plane-wave basis set as implemented in the Vienna ab initio simulation package (VASP) code37.
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