Bibliographie der Universität Regensburg

Dehnhardt, Natalie , Luy, Jan‐Niclas, Klement, Philip, Schipplick, Luca, Chatterjee, Sangam , Tonner, Ralf und Heine, Johanna (2021) Mixed Group 14–15 Metalates as Model Compounds for Doped Lead Halide Perovskites. Angewandte Chemie International Edition 60 (8), S. 3906-3911.

David, David (2020) Development of local Coupled Cluster response methods for high-spin open-shell molecules. Dissertation, Universität Regensburg.

Deaton, Joseph C., Taliaferro, Chelsea M., Pitman, Catherine L. , Czerwieniec, Rafał , Jakubikova, Elena, Miller, Alexander J. M. und Castellano, Felix N. (2018) Excited-State Switching between Ligand-Centered and Charge Transfer Modulated by Metal–Carbon Bonds in Cyclopentadienyl Iridium Complexes. Inorganic Chemistry 57 (24), S. 15445-15461. Volltext nicht vorhanden.

Masur, Oliver (2016) A fragment-based embedded approach for periodic systems and enhanced weak-pair treatment of molecular LCCSD, both based on direct-local-ring-CCD. Dissertation, Universität Regensburg.

Schütz, Martin, Masur, Oliver und Usvyat, Denis (2014) Efficient and accurate treatment of weak pairs in local CCSD(T) calculations. II. Beyond the ring approximation. The Journal of Chemical Physics 140 (24). Volltext nicht vorhanden.

Loibl, Stefan und Schütz, Martin (2012) NMR shielding tensors for density fitted local second-order Møller-Plesset perturbation theory using gauge including atomic orbitals. Journal of Chemical Physics 137, 084107.

Wälz, Gero, Kats, Daniel , Usvyat, Denis , Korona, Tatiana und Schütz, Martin (2012) Application of Hermitian time-dependent coupled-cluster responseAnsätzeof second order to excitation energies and frequency-dependent dipole polarizabilities. Physical Review A 86 (5). Volltext nicht vorhanden.

Usvyat, Denis , Maschio, Lorenzo , Manby, Frederick R., Casassa, Silvia , Schütz, Martin und Pisani, Cesare (2007) Fast local-MP2 method with density-fitting for crystals. II. Test calculations and application to the carbon dioxide crystal. Physical Review B 76 (7). Volltext nicht vorhanden.

Schemmel, Dominik und Schütz, Martin (2007) Phenol-water1⩽n⩽3 revisited: An ab initio study on the photophysics of these clusters at the level of coupled cluster response theory. The Journal of Chemical Physics 127 (17). Volltext nicht vorhanden.

Nest, M. und Meyer, H.-D. (2003) Dissipative quantum dynamics of anharmonic oscillators with the multiconfiguration time-dependent Hartree method. The Journal of Chemical Physics 119 (1), S. 24-33. Volltext nicht vorhanden.

Steinborn, E. O., Homeier, H. H. H., Ema, I., López, R. und Ramírez, G. (2000) Molecular calculations with B functions. International journal of quantum chemistry Int. J. Quantum Chem. 76 (2), S. 244-251. Volltext nicht vorhanden.

Homeier, H. H. H. (1998) On Convergence Acceleration of Multipolar and Orthogonal Expansions. In: 4th Electronic Computational Chemistry Conference, 1998, Internet.

Homeier, H. H. H. (1997) Extended Complex Series Methods for the Convergence Acceleration of Fourier Series. Technischer Bericht. (Unveröffentlicht)

Homeier, Herbert H. H. (1997) On Properties and the Application of Levin-type Sequence Transformations for the Convergence Acceleration of Fourier Series. Technischer Bericht. (Unveröffentlicht)

Steinborn, E. O., Homeier, H. H. H. und Weniger, E. J. (1992) Recent Progress on Representations for Coulomb Integrals of Exponential-type Orbitals. Journal of molecular structure. Theochem : J. Mol. Struct. (Theochem) 260, S. 207-221. Volltext nicht vorhanden.

Steinborn, E. O. und Homeier, H. H. H. (1990) Möbius-Type Quadrature of Electron Repulsion Integrals with B Functions. International journal of quantum chemistry. Symposium : Int. J. Quantum Chem. Symp. 24, S. 349-363. Volltext nicht vorhanden.