polytypes",
}
+@Misc{talk2004,
+ title = "{Monte-Carlo-Simulation der Selbstorganisation
+ amorpher nonometrischer SiC$_x$-Ausscheidungen in
+ Silizium w{\"a}hrend C$^+$-Ionen-Implantation}",
+ author = "F. Zirkelbach and M. H{\"a}berlen and J. K. N. Lindner
+ and B. Stritzker",
+ year = "2004",
+ month = "02",
+ note = "AKF-Fr{\"u}hjahrstagung der DPG, Regensburg, 02/2004,
+ DS 1.4",
+}
+
+@Misc{talk2005,
+ title = "{Kinetik des Selbstorganisationsvorganges bei der
+ Bildung von SiC$_x$-Ausscheidungs-Arrays in
+ C$^+$-Ionen-implantierten Silizium}",
+ author = "F. Zirkelbach and M. H{\"a}berlen and J. K. N. Lindner
+ and B. Stritzker",
+ year = "2005",
+ month = "02",
+ note = "69. Jahrestagung der DPG, Berlin, 02/2005, DS 8.6",
+}
+
+@Misc{talk2008,
+ title = "Molecular dynamics simulation study of the silicon
+ carbide precipitation process",
+ author = "F. Zirkelbach and J. K. N. Lindner and K. Nordlund and
+ B. Stritzker",
+ year = "2008",
+ month = "01",
+ note = "72. Annual Meeting and DPG-Spring Meeting 2008,
+ Berlin, 01/2008, DS 42.2",
+}
+
+@Misc{poster2006,
+ title = "Monte Carlo simulation study of a selforganization
+ process leading to ordered precipitate structures",
+ author = "F. Zirkelbach and M. H{\"a}berlen and J. K. N. Lindner
+ and B. Stritzker",
+ year = "2006",
+ month = "09",
+ note = "IBMM 2006, Taormina (Sicily), 09/2006, M243",
+}
+
@Article{zirkelbach2007,
title = "Monte Carlo simulation study of a selforganisation
process leading to ordered precipitate structures",
Co. KGaA, Weinheim)",
}
+@Article{zirkelbach15,
+ title = "Large-scale atomic effective pseudopotential program
+ including an efficient spin-orbit coupling treatment in
+ real space",
+ author = "F. Zirkelbach and P.-Y. Prodhomme and Peng Han and R.
+ Cherian and G. Bester",
+ journal = "Phys. Rev. B",
+ volume = "91",
+ issue = "7",
+ pages = "075119",
+ numpages = "16",
+ year = "2015",
+ month = feb,
+ publisher = "American Physical Society",
+ doi = "10.1103/PhysRevB.91.075119",
+ URL = "http://link.aps.org/doi/10.1103/PhysRevB.91.075119",
+ abstract = "Within the scheme of the {\em Large-scale Atomic
+ Effective Pseudopotential Program}, the Schr{\"o}dinger
+ equation of an electronic system is solved within an
+ effective single-particle approach. Although not
+ limited to, it focuses on the recently introduced
+ atomic effective pseudopotentials derived from screened
+ local effective crystal potentials as obtained from
+ self-consistent density functional theory calculations.
+ Plane waves are used to expand the wavefunctions. The
+ problem can be solved in both, real and reciprocal
+ space. Using atomic effective pseudopotentials, a
+ self-consistency cycle is not required, which
+ drastically reduces the computational effort.
+ Furthermore, without having to find a self-consistent
+ solution, which would require the determination of all
+ eigenstates, iterative solvers can be used to focus
+ only on a few eigenstates in the vicinity of a
+ reference energy, e.g.\ around the band gap of a
+ semiconductor. Hence, this approach is particularly
+ well suited for theoretical investigations of the
+ electronic structure of semiconductor nanostructures
+ consisting of up to several thousands of atoms.
+ Moreover, a novel and efficient real space treatment of
+ spin-orbit coupling within the pseudopotential
+ framework is proposed in this work allowing for a fully
+ relativistic description.",
+}
+
@Article{lindner95,
author = "J. K. N. Lindner and A. Frohnwieser and B.
Rauschenbach and B. Stritzker",
publisher = "American Physical Society",
}
+@Article{briggs96,
+ title = "Real-space multigrid-based approach to large-scale
+ electronic structure calculations",
+ author = "E. L. Briggs and D. J. Sullivan and J. Bernholc",
+ journal = "Phys. Rev. B",
+ volume = "54",
+ issue = "20",
+ pages = "14362--14375",
+ numpages = "0",
+ year = "1996",
+ month = nov,
+ publisher = "American Physical Society",
+ doi = "10.1103/PhysRevB.54.14362",
+ URL = "http://link.aps.org/doi/10.1103/PhysRevB.54.14362",
+}
+
+@Article{beck2000,
+ title = "Real-space mesh techniques in density-functional
+ theory",
+ author = "Thomas L. Beck",
+ journal = "Rev. Mod. Phys.",
+ volume = "72",
+ issue = "4",
+ pages = "1041--1080",
+ numpages = "0",
+ year = "2000",
+ month = oct,
+ publisher = "American Physical Society",
+ doi = "10.1103/RevModPhys.72.1041",
+ URL = "http://link.aps.org/doi/10.1103/RevModPhys.72.1041",
+}
+
@Article{saad10,
author = "Y. Saad and J. Chelikowsky and S. Shontz",
title = "Numerical Methods for Electronic Structure