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orbitals in electronic structure calculations 2012-05-10 Paper Numerical Solution of the Hartree–Fock Equation in Multilevel Tensor-Structured Format 2011-10-28...

Using real space pseudopotentials for the electronic structure problem 2005-04-05 Paper Electronic structure calculations for plane-wave codes without...

of products of orbitals in electronic structure calculations 2012-05-10 Paper Tensor decomposition in electronic structure calculations on 3D Cartesian...

Paper Spectral quadrature method for accurate \(\mathcal{O}(N)\) electronic structure calculations of metals and insulators 2016-12-14 Paper Hybrid preconditioning...

integrals in electronic structure calculations 2019-03-18 Paper A Numerical Method for Calculating the Green's Function Arising from Electronic Structure Theory...

gas trapped in a quartic potential 2012-06-26 Paper CALCULATION OF ELECTRONIC STRUCTURE OF A SPHERICAL QUANTUM DOT USING A COMBINATION OF QUANTUM GENETIC...

Kohn–Sham Equation 2008-09-23 Paper State-of-the-art eigensolvers for electronic structure calculations of large scale nano-systems 2008-07-29 Paper Surface...

representation of one-particle wavefunctions and scalar fields obtained from electronic-structure calculations 2023-05-10 Paper TCMI: a non-parametric mutual-dependence...

in augmented plane wave based methods in electronic structure calculations 2010-01-25 Paper Electronic structure calculations of solids using the WIEN2k...

density of states, core-level and optical spectra from electronic structure codes 2016-09-13 Paper Electronic energy minimisation with ultrasoft pseudopotentials...

methods for structure alignments 2007-09-10 Paper Density-based globally convergent trust-region methods for self-consistent field electronic structure calculations...

in electronic structure calculations 2021-03-01 Paper Convergence study of isogeometric analysis based on Bézier extraction in electronic structure calculations...

Structure 2009-01-08 Paper Electronic Structure 2009-01-08 Paper Object-oriented construction of a multigrid electronic-structure code with Fortran 90 2001-08-16...

Publication Date of Publication Type The electronic structure of disordered system 1964-01-01 Paper The electronic structure of liquid insulators 1963-01-01 Paper...

2023-11-14 Paper Numerical analysis of multiple scattering theory for electronic structure calculations 2023-08-14 Paper Mining Spatial-Temporal Similarity...

in electronic structure calculations 2021-03-01 Paper Convergence study of isogeometric analysis based on Bézier extraction in electronic structure calculations...

Date of Publication Type A projector augmented wave (PAW) code for electronic structure calculations. I: Atompaw for generating atom-centered functions 2002-05-12...

Date of Publication Type A projector augmented wave (PAW) code for electronic structure calculations. I: Atompaw for generating atom-centered functions 2002-05-12...

Publication Date of Publication Type Electronic structure calculations for plane-wave codes without diagonalization 2002-09-02 Paper HARES: An efficient...

IV 1948-01-01 Paper The electronic structure of conjugated systems I. General theory 1947-01-01 Paper The electronic structure of conjugated systems II...