Corrigendum.
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- 2013
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- Correction Notice
Works matching IS 01928651 AND DT 2013 AND VI 34 AND IP 27
Results: 12
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Erratum.
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- 2013
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- Correction Notice
3
Erratum.
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- 2013
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- Correction Notice
4
Convergence in the QM-Only and QM/MM Modeling of Enzymatic Reactions: A Case Study for Acetylene Hydratase.
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- Journal of Computational Chemistry, 2013, v. 34, n. 27, p. 2389, doi. 10.1002/jcc.23403
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- Article
5
Contributions of Pauli Repulsions to the Energetics and Physical Properties Computed in QM/MM Methods.
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- Journal of Computational Chemistry, 2013, v. 34, n. 27, p. 2380, doi. 10.1002/jcc.23401
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- Article
6
Accurate Relativistic Adapted Gaussian Basis Sets for Francium through Ununoctium without Variational Prolapse and to Be Used with Both Uniform Sphere and Gaussian Nucleus Models.
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- Journal of Computational Chemistry, 2013, v. 34, n. 27, p. 2372, doi. 10.1002/jcc.23400
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- Article
7
Overcoming Dissipation in the Calculation of Standard Binding Free Energies by Ligand Extraction.
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- Journal of Computational Chemistry, 2013, v. 34, n. 27, p. 2360, doi. 10.1002/jcc.23398
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- Article
8
Finite-Field Method with Unbiased Polarizable Continuum Model for Evaluation of the Second Hyperpolarizability of an Open-Shell Singlet Molecule in Solvents.
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- Journal of Computational Chemistry, 2013, v. 34, n. 27, p. 2345, doi. 10.1002/jcc.23395
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- Article
9
Long-Range Corrected Density Functionals Combined with Local Response Dispersion: A Promising Method for Weak Interactions.
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- Journal of Computational Chemistry, 2013, v. 34, n. 27, p. 2353, doi. 10.1002/jcc.23396
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- Article
10
Spin-Component-Scaled Double Hybrids: An Extensive Search for the Best Fifth-Rung Functionals Blending DFT and Perturbation Theory.
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- Journal of Computational Chemistry, 2013, v. 34, n. 27, p. 2327, doi. 10.1002/jcc.23391
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- Article
11
Ab Initio Study of the High-Temperature Phase Transition in Crystalline GeO<sub>2</sub>.
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- Journal of Computational Chemistry, 2013, v. 34, n. 27, p. 2320, doi. 10.1002/jcc.23387
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- Article
12
Efficient Optimization of van der Waals Parameters from Bulk Properties.
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- Journal of Computational Chemistry, 2013, v. 34, n. 27, p. 2313, doi. 10.1002/jcc.23376
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- Article