- Home
- Publications
- Publication Search
- Publication Details
Title
Effective Two-Body Interactions
Authors
Keywords
-
Journal
JOURNAL OF PHYSICAL CHEMISTRY A
Volume 125, Issue 35, Pages 7750-7758
Publisher
American Chemical Society (ACS)
Online
2021-08-31
DOI
10.1021/acs.jpca.1c05677
References
Ask authors/readers for more resources
Related references
Note: Only part of the references are listed.- From Intermolecular Interaction Energies and Observable Shifts to Component Contributions and Back Again: A Tale of Variational Energy Decomposition Analysis
- (2021) Yuezhi Mao et al. Annual Review of Physical Chemistry
- The Many-Body Expansion for Aqueous Systems Revisited: II. Alkali Metal and Halide Ion–Water Interactions
- (2021) Joseph P. Heindel et al. Journal of Chemical Theory and Computation
- Nature of Alkali Ion–Water Interactions: Insights from Many-Body Representations and Density Functional Theory. II
- (2020) Colin K. Egan et al. Journal of Chemical Theory and Computation
- Stepwise Activation of Water by Open-Shell Interactions, Cl(H2O)n=4–8,17
- (2020) Elizabeth G. Christensen et al. JOURNAL OF PHYSICAL CHEMISTRY A
- How good are polarizable and flexible models for water: Insights from a many-body perspective
- (2020) Eleftherios Lambros et al. JOURNAL OF CHEMICAL PHYSICS
- The Many-Body Expansion for Aqueous Systems Revisited: I. Water–Water Interactions
- (2020) Joseph P. Heindel et al. Journal of Chemical Theory and Computation
- On the Nature of Halide-Water Interactions: Insights from Many-Body Representations and Density Functional Theory
- (2019) Brandon B. Bizzarro et al. Journal of Chemical Theory and Computation
- Cavity Catalysis by Cooperative Vibrational Strong Coupling of Reactant and Solvent Molecules
- (2019) Jyoti Lather et al. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION
- Assessing Many-Body Effects of Water Self-Ions. II: H3O+(H2O)n Clusters
- (2019) Colin K. Egan et al. Journal of Chemical Theory and Computation
- Acid solvation versus dissociation at “stardust conditions”: Reaction sequence matters
- (2019) Devendra Mani et al. Science Advances
- Development of an Advanced Force Field for Water Using Variational Energy Decomposition Analysis
- (2019) Akshaya K. Das et al. Journal of Chemical Theory and Computation
- Fantasy versus reality in fragment-based quantum chemistry
- (2019) John M. Herbert JOURNAL OF CHEMICAL PHYSICS
- Ion Pairing in HCl–Water Clusters: From Electronic Structure Investigations to Multiconfigurational Force-Field Development
- (2019) Caitlin G. Bresnahan et al. JOURNAL OF PHYSICAL CHEMISTRY A
- Assessing Many-Body Effects of Water Self-Ions. I: OH–(H2O)n Clusters
- (2018) Colin K. Egan et al. Journal of Chemical Theory and Computation
- Assessing many-body contributions to intermolecular interactions of the AMOEBA force field using energy decomposition analysis of electronic structure calculations
- (2017) Omar Demerdash et al. JOURNAL OF CHEMICAL PHYSICS
- Thirty years of density functional theory in computational chemistry: an overview and extensive assessment of 200 density functionals
- (2017) Narbe Mardirossian et al. MOLECULAR PHYSICS
- Insights into acid dissociation of HCl and HBr with internal electric fields
- (2017) Manjusha Boda et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- A look at the density functional theory zoo with the advanced GMTKN55 database for general main group thermochemistry, kinetics and noncovalent interactions
- (2017) Lars Goerigk et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- Cooperativity in Noncovalent Interactions
- (2016) A. Subha Mahadevi et al. CHEMICAL REVIEWS
- From Additivity to Cooperativity in Chemistry: Can Cooperativity Be Measured?
- (2016) Ludger Tebben et al. CHEMISTRY-A EUROPEAN JOURNAL
- How Many Water Molecules Does it Take to Dissociate HCl?
- (2016) Alba Vargas-Caamal et al. CHEMISTRY-A EUROPEAN JOURNAL
- Advanced Potential Energy Surfaces for Molecular Simulation
- (2016) Alex Albaugh et al. JOURNAL OF PHYSICAL CHEMISTRY B
- Probing non-covalent interactions with a second generation energy decomposition analysis using absolutely localized molecular orbitals
- (2016) Paul R. Horn et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- Cooperative or Anticooperative: How Noncovalent Interactions Influence Each Other
- (2015) Soumen Saha et al. JOURNAL OF PHYSICAL CHEMISTRY B
- Advances in molecular quantum chemistry contained in the Q-Chem 4 program package
- (2014) Yihan Shao et al. MOLECULAR PHYSICS
- Reactivity Models of Hydrogen Activation by Frustrated Lewis Pairs: Synergistic Electron Transfers or Polarization by Electric Field?
- (2013) Tibor András Rokob et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- ωB97X-V: A 10-parameter, range-separated hybrid, generalized gradient approximation density functional with nonlocal correlation, designed by a survival-of-the-fittest strategy
- (2013) Narbe Mardirossian et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- Strength of hydrogen bonds of water depends on local environment
- (2012) Matej Huš et al. JOURNAL OF CHEMICAL PHYSICS
- Examination of the hydrogen-bonding networks in small water clusters (n = 2–5, 13, 17) using absolutely localized molecular orbital energy decomposition analysis
- (2012) Erika A. Cobar et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- Fragmentation Methods: A Route to Accurate Calculations on Large Systems
- (2011) Mark S. Gordon et al. CHEMICAL REVIEWS
- Interaction energies of large clusters from many-body expansion
- (2011) Urszula Góra et al. JOURNAL OF CHEMICAL PHYSICS
- Cooperative multimetallic catalysis using metallosalens
- (2010) Robert M. Haak et al. CHEMICAL COMMUNICATIONS
- Property-optimized Gaussian basis sets for molecular response calculations
- (2010) Dmitrij Rappoport et al. JOURNAL OF CHEMICAL PHYSICS
- Current Status of the AMOEBA Polarizable Force Field
- (2010) Jay W. Ponder et al. JOURNAL OF PHYSICAL CHEMISTRY B
- Aggregation-Induced Dissociation of HCl(H2O)4 Below 1 K: The Smallest Droplet of Acid
- (2009) A. Gutberlet et al. SCIENCE
- Electron Donation in the Water-Water Hydrogen Bond
- (2008) Rustam Z. Khaliullin et al. CHEMISTRY-A EUROPEAN JOURNAL
Find the ideal target journal for your manuscript
Explore over 38,000 international journals covering a vast array of academic fields.
SearchBecome a Peeref-certified reviewer
The Peeref Institute provides free reviewer training that teaches the core competencies of the academic peer review process.
Get Started