Molecules | Free Full-Text | Double-Hybrid DFT Functionals for the Condensed Phase: Gaussian and Plane Waves Implementation and Evaluation
Model for the fast estimation of basis set superposition error in biomolecular systems: The Journal of Chemical Physics: Vol 135, No 14
How to calculate the absorption spectra of a molecule using Gaussian? | ResearchGate
Gaussian Basis Sets for Crystalline Solids: All-Purpose Basis Set Libraries vs System-Specific Optimizations | Journal of Chemical Theory and Computation
How to calculate HOMO LUMO using DFT using gaussina 09 ? | ResearchGate
Using Gaussian probability density functions to describe and predict... | Download Scientific Diagram
PDF) Basis Set Superposition Error Effects Cause the Apparent Nonexistence of the Ethene/Benzenium Ion Complex on the MP2 Potential Energy Surface | Tanja Van Mourik - Academia.edu
Online Gaussian Workshop - INSILICOSCI
Small Atomic Orbital Basis Set First‐Principles Quantum Chemical Methods for Large Molecular and Periodic Systems: A Critical Analysis of Error Sources - Sure - 2016 - ChemistryOpen - Wiley Online Library
How can i using gaussian 09 to optimize a molecule on different concentration? | ResearchGate
![PDF] Elimination of basis set superposition error in linear-scaling density-functional calculations with local orbitals optimised in situ | Semantic Scholar](https://d3i71xaburhd42.cloudfront.net/baccceaa7fbd88594e5bfb4730515c9d50e7a21f/8-Table1-1.png "PDF] Elimination of basis set superposition error in linear-scaling density-functional calculations with local orbitals optimised in situ | Semantic Scholar")
PDF] Elimination of basis set superposition error in linear-scaling density-functional calculations with local orbitals optimised in situ | Semantic Scholar
Using Fragments in Gaussian - YouTube
![PDF] A geometrical correction for the inter- and intra-molecular basis set superposition error in Hartree-Fock and density functional theory calculations for large systems. | Semantic Scholar](https://d3i71xaburhd42.cloudfront.net/fe30dc5063c8eeff18f65bde6fd5ebf9c12571cc/11-Figure3-1.png "PDF] A geometrical correction for the inter- and intra-molecular basis set superposition error in Hartree-Fock and density functional theory calculations for large systems. | Semantic Scholar")
PDF] A geometrical correction for the inter- and intra-molecular basis set superposition error in Hartree-Fock and density functional theory calculations for large systems. | Semantic Scholar
Tutorial: Intermolecular Interactions
Molecules | Free Full-Text | On the Use of Popular Basis Sets: Impact of the Intramolecular Basis Set Superposition Error
Model for the fast estimation of basis set superposition error in biomolecular systems: The Journal of Chemical Physics: Vol 135, No 14
Using Gaussview to prepare an input with counterpoise correction - YouTube
Some Observations on Counterpoise Corrections for Explicitly Correlated Calculations on Noncovalent Interactions | Journal of Chemical Theory and Computation
Does anyone know which keyword I should use for calculating the interaction energy of two molecules in G09? | ResearchGate
Gaussian Manual | PDF | Computational Chemistry | Computer File
Using Gaussview to prepare an input with counterpoise correction - YouTube
Efficiency of numerical basis sets for predicting the binding energies of hydrogen bonded complexes: Evidence of small basis set superposition error compared to Gaussian basis sets - Inada - 2008 - Journal
Implementation and application of basis set superposition error-correction schemes to the theoretical modeling of weak intermole
Model for the fast estimation of basis set superposition error in biomolecular systems: The Journal of Chemical Physics: Vol 135, No 14
Development of Polarizable Gaussian Model for Molecular Mechanical Calculations I: Atomic Polarizability Parameterization To Reproduce ab Initio Anisotropy | Journal of Chemical Theory and Computation
Carlier Group Gaussian User Manual - Virginia Tech
Tutorial 16 | How to Calculate Binding and Interaction Energies with Gaussian | Dr M A Hashmi - YouTube
