Stella Stopkowicz

Image of Stella Stopkowicz
Norwegian version of this page
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Visiting address Sem Sælands vei 26 0371 Oslo
Postal address Postboks 1033 0315 Oslo
Tags: Chemistry, Theoretical chemistry

Publications

  • Holzer, Christof; Teale, Andrew Michael; Hampe, Florian; Stopkowicz, Stella; Helgaker, Trygve & Klopper, Wim (2019). GW quasiparticle energies of atoms in strong magnetic fields. Journal of Chemical Physics. ISSN 0021-9606. 150(21), p. 214112-1–214112-9. doi: 10.1063/1.5093396.
  • Reimann, Sarah; Borgoo, Alex; Austad, Jon; Tellgren, Erik; Teale, Andrew Michael & Helgaker, Trygve (2019). Kohn–Sham energy decomposition for molecules in a magnetic field. Molecular Physics. ISSN 0026-8976. 117(1), p. 97–109. doi: 10.1080/00268976.2018.1495849.
  • Furness, James W.; Verbeke, Joachim; Tellgren, Erik; Stopkowicz, Stella; Ekström, Ulf Egil & Helgaker, Trygve [Show all 7 contributors for this article] (2015). Current density functional theory using meta-generalized gradient exchange-correlation functionals. Journal of Chemical Theory and Computation. ISSN 1549-9618. 11(9), p. 4169–4181. doi: 10.1021/acs.jctc.5b00535.
  • Stopkowicz, Stella; Gauss, Jürgen; Lange, Kai Kaarvann; Tellgren, Erik & Helgaker, Trygve (2015). Coupled-cluster theory for atoms and molecules in strong magnetic fields. Journal of Chemical Physics. ISSN 0021-9606. 143:074110(7). doi: 10.1063/1.4928056.
  • Epifanovsky, Evgeny; Klein, Kerstin; Stopkowicz, Stella; Gauss, Jürgen & Krylov, Anna I. (2015). Spin-orbit couplings within the equation-of-motion coupled-cluster framework: Theory, implementation, and benchmark calculations. Journal of Chemical Physics. ISSN 0021-9606. 143:064102(6). doi: 10.1063/1.4927785.
  • Reimann, Sarah; Ekström, Ulf Egil; Stopkowicz, Stella; Teale, Andrew Michael; Borgoo, Alex & Helgaker, Trygve (2015). The importance of current contributions to shielding constants in density-functional theory. Physical Chemistry, Chemical Physics - PCCP. ISSN 1463-9076. 17(28), p. 18834–18842. doi: 10.1039/c5cp02682b.
  • Stopkowicz, Stella & Gauss, Jürgen (2014). Revised values for the nuclear quadrupole moments of S33 and S35. Physical Review A. Atomic, Molecular, and Optical Physics (PRA). ISSN 1050-2947. 90(2). doi: 10.1103/PhysRevA.90.022507.
  • Cheng, Lan; Stopkowicz, Stella & Gauss, Jürgen (2014). Analytic Energy Derivatives in Relativistic Quantum Chemistry. International Journal of Quantum Chemistry. ISSN 0020-7608. 114(17), p. 1108–1127. doi: 10.1002/qua.24636.
  • Cheng, Lan; Stopkowicz, Stella & Gauss, Jürgen (2013). Spin-free Dirac-Coulomb calculations augmented with a perturbative treatment of spin-orbit effects at the Hartree-Fock level. Journal of Chemical Physics. ISSN 0021-9606. 139. doi: 10.1063/1.4832739.
  • Stopkowicz, Stella; Cheng, Lan; Harding, Michael E.; Puzzarini, Cristina & Gauss, Jürgen (2013). The bromine nuclear quadrupole moment revisited. Molecular Physics. ISSN 0026-8976. 111(9-11), p. 1382–1389. doi: 10.1080/00268976.2013.796072.
  • Cheng, Lan; Stopkowicz, Stella; Stanton, John F. & Gauss, Jurgen (2012). The route to high accuracy in ab initio calculations of Cu quadrupole-coupling constants. Journal of Chemical Physics. ISSN 0021-9606. 137(22). doi: 10.1063/1.4767767.

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  • Eriksen, Janus J.; Stopkowicz, Stella; Jagau, Thomas-C. & Helgaker, Trygve (2020). Foreword: Prof. Gauss Festschrift. Molecular Physics. ISSN 0026-8976. 118. doi: 10.1080/00268976.2020.1817247.
  • Holzer, Christof; Teale, Andrew Michael; Hampe, Florian; Stopkowicz, Stella; Helgaker, Trygve & Klopper, Wim (2019). Erratum: “GW quasiparticle energies of atoms in strong magnetic fields” [J. Chem. Phys. 150, 214112 (2019)]. Journal of Chemical Physics. ISSN 0021-9606. 151. doi: 10.1063/1.5120100.
  • Helgaker, Trygve; Borgoo, Alex; Dimitrova, Maria; Gauss, Jurgen; Hampe, Florian & Holzer, Christof [Show all 13 contributors for this article] (2018). Diamagnetism and Paramagnetism in Atoms and Molecules.
  • Helgaker, Trygve; Borgoo, Alex; Gauss, Jurgen; Hampe, Florian; Klopper, Wim & Reimann, Sarah [Show all 9 contributors for this article] (2018). Closed-Shell Molecular Paramagnetism.
  • Helgaker, Trygve; Borgoo, Alex; Gauss, Jurgen; Hampe, Florian; Klopper, Wim & Reimann, Sarah [Show all 9 contributors for this article] (2018). Closed-Shell Molecular Paramagnetism.
  • Helgaker, Trygve; Borgoo, Alex; Gauss, Jurgen; Hampe, Florian; Klopper, Wim & Stopkowicz, Stella [Show all 8 contributors for this article] (2018). Closed-Shell Molecular Magnetism.
  • Stopkowicz, Stella & Helgaker, Trygve (2014). Coupled-Cluster Theory for Molecules in Strong Magnetic Fields.
  • Stopkowicz, Stella; Cheng, Lan & Gauss, Jurgen (2014). Accurate Determination of Nuclear Quadrupole Moments and Quadrupole-Coupling Constants.
  • Stopkowicz, Stella & Helgaker, Trygve (2013). Correlated molecular energies in strong magnetic fields.
  • Stopkowicz, Stella (2013). Does Direct Perturbation Theory converge?
  • Stopkowicz, Stella (2013). Does Direct Perturbation Theory converge?

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Published Nov. 30, 2021 5:24 PM - Last modified Dec. 1, 2021 4:46 PM