Aarhus University Seal / Aarhus Universitets segl

Jeppe Olsen

  1. Published

    Linear-scaling implementation of molecular electronic self-consistent field theory. / Salek, Pawel; Høst, Stinne; Thøgersen, Lea; Jørgensen, Poul; Manninen, Pekka; Olsen, Jeppe; Jansik, Branislav; Reine, Simen; Pawlowski, Filip; Tellgren, Erik; Helgaker, Trygve; Coriani, Sonia.

    In: Journal of Chemical Physics, Vol. 126, 2007, p. 114110-1 - 114110-16.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaperJournal articleResearchpeer-review

  2. Published

    Linear-scaling implementation of molecular response theory in self-consistent field electronic-structure theory. / Coriani, Sonia; Høst, Stinne; Jansik, Branislav; Thøgersen, Lea; Olsen, Jeppe; Jørgensen, Poul; Reine, Simen; Pawlowski, Filip; Helgaker, Trygve; Salek, Pawel.

    In: Journal of Chemical Physics, Vol. 126, No. 15, 2007, p. 154108-1 - 154108-11.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaperJournal articleResearchpeer-review

  3. Published

    Linear-scaling symmetric square-root decomposition of the overlap matrix. / Jansik, Branislav; Høst, Stinne; Jørgensen, Poul; Olsen, Jeppe; Helgaker, Trygve.

    In: Journal of Chemical Physics, Vol. 126, 2007, p. 124104-9.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaperJournal articleResearchpeer-review

  4. Published

    Maximum locality in occupied and virtual orbital spaces using a least change strategy. / Ziolkowski, Marcin; Jansik, Branislav; Jørgensen, Poul; Olsen, Jeppe.

    In: Journal of Chemical Physics, Vol. 131, 2009, p. 124112.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaperJournal articleResearchpeer-review

  5. Published

    Molecular equilibrium structures from experimental rotational constants and calculated vibration-rotation interaction constants. / Pawlowski, F.; Jørgensen, P.; Olsen, J.; Hegelund, Flemming; Helgaker, T.; Gauss, J.; Bak, K.L.; Stanton, J.F.

    In: Journal of Chemical Physics, Vol. 116, 2002, p. 6482-6496.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaperJournal articleResearch

  6. Published

    Molecular response properties from a Hermitian eigenvalue equation for a time-periodic Hamiltonian. / Pawlowski, Filip Ludwik; Olsen, Jeppe; Jørgensen, Poul.

    In: Journal of Chemical Physics, Vol. 142, No. 11, 114109, 2015.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaperJournal articleResearchpeer-review

  7. Published

    Molecular response properties in equation of motion coupled cluster theory : A time-dependent perspective. / Coriani, Sonia; Pawlowski, Filip Ludwik; Olsen, Jeppe; Jørgensen, Poul.

    In: Journal of Chemical Physics, Vol. 144, No. 2, 024102, 14.01.2016.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaperJournal articleResearchpeer-review

  8. Published

    Multiconfiguration Pair-Density Functional Theory. / Li Manni, Giovanni; Carlson, Rebecca K; Luo, Sijie; Ma, Dongxie; Olsen, Jeppe; Truhlar, Donald G; Gagliardi, Laura.

    In: Journal of Chemical Theory and Computation, Vol. 10, No. 9, 09.2014, p. 3669-3680.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaperJournal articleResearchpeer-review

  9. Published

    Non-orthogonal internally contracted multi-configurational perturbation theory (NICPT) : Dynamic electron correlation for large, compact active spaces. / Kähler, Sven; Olsen, Jeppe.

    In: Journal of Chemical Physics, Vol. 147, No. 17, 174106, 07.11.2017.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaperJournal articleResearchpeer-review

  10. Published

    Novel methods for configuration interaction and orbital optimization for wave functions containing non-orthogonal orbitals with applications to the chromium dimer and trimer. / Olsen, Jeppe.

    In: Journal of Chemical Physics, Vol. 143, No. 11, 114102, 2015.

    Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaperJournal articleResearchpeer-review