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Disambiguation of "Werner, Hans Joachim"

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Scalable Electron Correlation Methods : 7. Local Open-Shell Coupled-Cluster Methods Using Pair Natural Orbitals : PNO-RCCSD and PNO-UCCSD

, and . Journal of Chemical Theory and Computation, 16 (5): 3135-3151 (2020)
DOI: 10.1021/acs.jctc.0c00192

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Univ. -Prof. Dr. Hans-Joachim Werner University of Stuttgart

Hans-Joachim Bungartz

Hans-Joachim Bieg

Hans-Joachim Gehrmann University of Stuttgart

Hans-Werner Roth University of Stuttgart

 

Other publications of authors with the same name

Impact of local and density fitting approximations on harmonic vibrational frequencies, , and . J. Phys. Chem. A, 110 (5): 2060–2064 (February 2006)A comparison of metallophilic attraction in (X-M-PH₃)₂(M = Cu, Ag, Au; X = H, Cl), , , , , and . Phys. Chem. Chem. Phys., 4 (6): 1006–1013 (2002)Molpro: a general-purpose quantum chemistry program package, , , , and . Wiley Interdiscip. Rev. Comput. Mol. Sci., 2 (2): 242–253 (2011)Energetics and spin‐ and Λ‐doublet selectivity in the infrared multiphoton dissociation HN₃ ( X̃¹ A ')→N⁺ ( X¹ Σ⁺ g )+NH( X³Σ₂ , a¹Δ): Theory, , and . J. Chem. Phys., 89 (3): 1388–1400 (1988)Multireference perturbation theory for large restricted and selected active space reference wave functions, and . J. Chem. Phys., 112 (13): 5546–5557 (2000)Photodissociation dynamics of H₂S on new coupled ab initio potential energy surfaces, , and . J. Chem. Phys., 111 (10): 4523–4534 (1999)Dissociation of NH₃ to NH + H₂, , , , and . J. Chem. Soc. Faraday Trans., 87 (12): 1809–1814 (1991)Electron correlation effects on structural and cohesive properties of closo-hydroborate dianions (BnHn)₂₂ (n = 5–12) and B₄H₄, , , , and . Phys. Chem. Chem. Phys., 3 (4): 514–522 (2002)The orbital-specific virtual local triples correction: OSV-L(T), , , , and . J. Chem. Phys., 138 (5): 054109 (February 2013)Ab initio calculations of infrared transition rates in the ground states of BF and BF⁺, , and . Chem. Phys. Lett., 92 (3): 250–256 (October 1982)