Skip to contents Matta, Chérif F. [Editor]; Boyd, Russel J. [Other] The quantum theory of atoms in molecules : from solid state to DNA and drug design Books View online Schließen Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Weinheim: WILEY-VCH, 2007 Jenkins, Samantha [Author]; Kirk, Steven Robert [Author] Next Generation Quantum Theory of Atoms in Molecules : From Stereochemistry to Photochemistry and Molecular Devices - [1st ed. 2023.] Books View online Schließen > Access ... to E-book via DOI Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Singapore: Springer Nature Singapore, 2023. ; Singapore: Imprint: Springer, 2023. Published in: Lecture Notes in Chemistry ; 110 Hey, Jakob [Author] ; Stalke, Dietmar [Degree supervisor]; Meyer, Franc [Degree supervisor]; Farrugia, Louis J. [Degree supervisor] From X-ray diffraction data annealing to comprehensive charge density analysis Books View online Schließen > Access ... to E-book ... to E-book via Resolving system ... to E-book via German National Library Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Göttingen: Niedersächsische Staats- und Universitätsbibliothek Göttingen, 2013 Golub, Pavlo [Author] ; Ruck, Michael [Degree supervisor]; Grin, Yuri [Other] Chemical bonding analysis of complex solids in real space from the projector augmented-wave method Books View online Schließen > Access ... to E-book via Resolving system ... to E-book via German National Library Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Dresden: Saechsische Landesbibliothek- Staats- und Universitaetsbibliothek Dresden; Dresden: Technische Universität Dresden, 2017 Anderson, James S. M.; Rodríguez, Juan I.; Ayers, Paul W.; Götz, Andreas W. Relativistic (SR‐ZORA) quantum theory of atoms in molecules properties Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Wiley, 2017 Published in: Journal of Computational Chemistry, 38 (2017) 2, Seite 81-86 Smith, Ashlyn P.; McKercher, Adrienne E.; Mawhinney, Robert C. Inductive Effect: A Quantum Theory of Atoms in Molecules Perspective Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2011 Published in: The Journal of Physical Chemistry A, 115 (2011) 45, Seite 12544-12554 Bader, R. F. W. Topology and quantum theory of atoms in molecules and crystals Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. International Union of Crystallography (IUCr), 1996 Published in: Acta Crystallographica Section A Foundations of Crystallography, 52 (1996) a1, Seite C555-C555 García-Revilla, Marco; Francisco, E.; Costales, A.; Martín Pendás, A. Performance of the Density Matrix Functional Theory in the Quantum Theory of Atoms in Molecules Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2012 Published in: The Journal of Physical Chemistry A, 116 (2012) 4, Seite 1237-1250 Zadeh, Farnaz Heidar; Shahbazian, Shant Toward a fuzzy atom view within the context of the quantum theory of atoms in molecules: quasi-atoms Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Springer Science and Business Media LLC, 2011 Published in: Theoretical Chemistry Accounts, 128 (2011) 2, Seite 175-181 Blanco, M. A.; Martín Pendás, A.; Francisco, E. Interacting Quantum Atoms: A Correlated Energy Decomposition Scheme Based on the Quantum Theory of Atoms in Molecules Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2005 Published in: Journal of Chemical Theory and Computation, 1 (2005) 6, Seite 1096-1109 Rusakova, N. P.; Orlov, Yu. D. Homologs of Thioacetone and Acetone in the Quantum Theory of Atoms in Molecules Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Pleiades Publishing Ltd, 2024 Published in: Reviews and Advances in Chemistry, 14 (2024) 1, Seite 31-36 Grabowski, Slawomir J.; Krygowski, Tadeusz M.; Leszczynski, Jerzy An Analysis of Substituent Effects in Ethane Derivatives: The Quantum Theory of Atoms in Molecules Approach Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2009 Published in: The Journal of Physical Chemistry A, 113 (2009) 6, Seite 1105-1110 K. Macedo, Gabriel; Haiduke, Roberto L. A. A Quantum Theory Atoms in Molecules Study about the Inductive Effect of Substituents in Methane Derivatives Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2020 Published in: ACS Omega, 5 (2020) 15, Seite 9041-9045 Wilson, Timothy R.; Eberhart, M.E. Quantum theory of atoms in molecules in condensed charge density space Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Canadian Science Publishing, 2019 Published in: Canadian Journal of Chemistry, 97 (2019) 11, Seite 757-762 Ferro-Costas, David; Vila, Antonio; Mosquera, Ricardo A. Anomeric Effect in Halogenated Methanols: A Quantum Theory of Atoms in Molecules Study Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2013 Published in: The Journal of Physical Chemistry A, 117 (2013) 7, Seite 1641-1650 Lefrancois‐Gagnon, Kevin M.; Mawhinney, Robert C. Toward universal substituent constants: Transferability of group descriptors from the quantum theory of atoms in molecules Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Wiley, 2022 Published in: Journal of Computational Chemistry, 43 (2022) 4, Seite 265-278 Jabłoński, Mirosław; Palusiak, Marcin Basis Set and Method Dependence in Quantum Theory of Atoms in Molecules Calculations for Covalent Bonds Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2010 Published in: The Journal of Physical Chemistry A, 114 (2010) 47, Seite 12498-12505 Cossard, Alessandro; Desmarais, Jacques K.; Casassa, Silvia; Gatti, Carlo; Erba, Alessandro Charge Density Analysis of Actinide Compounds from the Quantum Theory of Atoms in Molecules and Crystals Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2021 Published in: The Journal of Physical Chemistry Letters, 12 (2021) 7, Seite 1862-1868 Popov, Alexey A.; Dunsch, Lothar Bonding in Endohedral Metallofullerenes as Studied by Quantum Theory of Atoms in Molecules Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Wiley, 2009 Published in: Chemistry – A European Journal, 15 (2009) 38, Seite 9707-9729 Bin, Xin; Azizi, Alireza; Xu, Tianlv; Kirk, Steven R.; Filatov, Michael; Jenkins, Samantha Next‐generation quantum theory of atoms in molecules for the photochemical ring‐opening reactions of oxirane Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Wiley, 2019 Published in: International Journal of Quantum Chemistry, 119 (2019) 16
Matta, Chérif F. [Editor]; Boyd, Russel J. [Other] The quantum theory of atoms in molecules : from solid state to DNA and drug design Books View online Schließen Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Weinheim: WILEY-VCH, 2007
Jenkins, Samantha [Author]; Kirk, Steven Robert [Author] Next Generation Quantum Theory of Atoms in Molecules : From Stereochemistry to Photochemistry and Molecular Devices - [1st ed. 2023.] Books View online Schließen > Access ... to E-book via DOI Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Singapore: Springer Nature Singapore, 2023. ; Singapore: Imprint: Springer, 2023. Published in: Lecture Notes in Chemistry ; 110
Hey, Jakob [Author] ; Stalke, Dietmar [Degree supervisor]; Meyer, Franc [Degree supervisor]; Farrugia, Louis J. [Degree supervisor] From X-ray diffraction data annealing to comprehensive charge density analysis Books View online Schließen > Access ... to E-book ... to E-book via Resolving system ... to E-book via German National Library Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Göttingen: Niedersächsische Staats- und Universitätsbibliothek Göttingen, 2013
Golub, Pavlo [Author] ; Ruck, Michael [Degree supervisor]; Grin, Yuri [Other] Chemical bonding analysis of complex solids in real space from the projector augmented-wave method Books View online Schließen > Access ... to E-book via Resolving system ... to E-book via German National Library Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Dresden: Saechsische Landesbibliothek- Staats- und Universitaetsbibliothek Dresden; Dresden: Technische Universität Dresden, 2017
Anderson, James S. M.; Rodríguez, Juan I.; Ayers, Paul W.; Götz, Andreas W. Relativistic (SR‐ZORA) quantum theory of atoms in molecules properties Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Wiley, 2017 Published in: Journal of Computational Chemistry, 38 (2017) 2, Seite 81-86
Smith, Ashlyn P.; McKercher, Adrienne E.; Mawhinney, Robert C. Inductive Effect: A Quantum Theory of Atoms in Molecules Perspective Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2011 Published in: The Journal of Physical Chemistry A, 115 (2011) 45, Seite 12544-12554
Bader, R. F. W. Topology and quantum theory of atoms in molecules and crystals Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. International Union of Crystallography (IUCr), 1996 Published in: Acta Crystallographica Section A Foundations of Crystallography, 52 (1996) a1, Seite C555-C555
García-Revilla, Marco; Francisco, E.; Costales, A.; Martín Pendás, A. Performance of the Density Matrix Functional Theory in the Quantum Theory of Atoms in Molecules Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2012 Published in: The Journal of Physical Chemistry A, 116 (2012) 4, Seite 1237-1250
Zadeh, Farnaz Heidar; Shahbazian, Shant Toward a fuzzy atom view within the context of the quantum theory of atoms in molecules: quasi-atoms Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Springer Science and Business Media LLC, 2011 Published in: Theoretical Chemistry Accounts, 128 (2011) 2, Seite 175-181
Blanco, M. A.; Martín Pendás, A.; Francisco, E. Interacting Quantum Atoms: A Correlated Energy Decomposition Scheme Based on the Quantum Theory of Atoms in Molecules Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2005 Published in: Journal of Chemical Theory and Computation, 1 (2005) 6, Seite 1096-1109
Rusakova, N. P.; Orlov, Yu. D. Homologs of Thioacetone and Acetone in the Quantum Theory of Atoms in Molecules Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Pleiades Publishing Ltd, 2024 Published in: Reviews and Advances in Chemistry, 14 (2024) 1, Seite 31-36
Grabowski, Slawomir J.; Krygowski, Tadeusz M.; Leszczynski, Jerzy An Analysis of Substituent Effects in Ethane Derivatives: The Quantum Theory of Atoms in Molecules Approach Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2009 Published in: The Journal of Physical Chemistry A, 113 (2009) 6, Seite 1105-1110
K. Macedo, Gabriel; Haiduke, Roberto L. A. A Quantum Theory Atoms in Molecules Study about the Inductive Effect of Substituents in Methane Derivatives Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2020 Published in: ACS Omega, 5 (2020) 15, Seite 9041-9045
Wilson, Timothy R.; Eberhart, M.E. Quantum theory of atoms in molecules in condensed charge density space Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Canadian Science Publishing, 2019 Published in: Canadian Journal of Chemistry, 97 (2019) 11, Seite 757-762
Ferro-Costas, David; Vila, Antonio; Mosquera, Ricardo A. Anomeric Effect in Halogenated Methanols: A Quantum Theory of Atoms in Molecules Study Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2013 Published in: The Journal of Physical Chemistry A, 117 (2013) 7, Seite 1641-1650
Lefrancois‐Gagnon, Kevin M.; Mawhinney, Robert C. Toward universal substituent constants: Transferability of group descriptors from the quantum theory of atoms in molecules Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Wiley, 2022 Published in: Journal of Computational Chemistry, 43 (2022) 4, Seite 265-278
Jabłoński, Mirosław; Palusiak, Marcin Basis Set and Method Dependence in Quantum Theory of Atoms in Molecules Calculations for Covalent Bonds Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2010 Published in: The Journal of Physical Chemistry A, 114 (2010) 47, Seite 12498-12505
Cossard, Alessandro; Desmarais, Jacques K.; Casassa, Silvia; Gatti, Carlo; Erba, Alessandro Charge Density Analysis of Actinide Compounds from the Quantum Theory of Atoms in Molecules and Crystals Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2021 Published in: The Journal of Physical Chemistry Letters, 12 (2021) 7, Seite 1862-1868
Popov, Alexey A.; Dunsch, Lothar Bonding in Endohedral Metallofullerenes as Studied by Quantum Theory of Atoms in Molecules Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Wiley, 2009 Published in: Chemistry – A European Journal, 15 (2009) 38, Seite 9707-9729
Bin, Xin; Azizi, Alireza; Xu, Tianlv; Kirk, Steven R.; Filatov, Michael; Jenkins, Samantha Next‐generation quantum theory of atoms in molecules for the photochemical ring‐opening reactions of oxirane Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Wiley, 2019 Published in: International Journal of Quantum Chemistry, 119 (2019) 16
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