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PDF] A new hybrid exchange–correlation functional using the  Coulomb-attenuating method (CAM-B3LYP) | Semantic Scholar
PDF] A new hybrid exchange–correlation functional using the Coulomb-attenuating method (CAM-B3LYP) | Semantic Scholar

Accurate prediction of the properties of materials using the CAM‐B3LYP  density functional - Li - 2021 - Journal of Computational Chemistry - Wiley  Online Library
Accurate prediction of the properties of materials using the CAM‐B3LYP density functional - Li - 2021 - Journal of Computational Chemistry - Wiley Online Library

Importance of Dispersion in the Molecular Geometries of Mn(III) Spin  Crossover Complexes
Importance of Dispersion in the Molecular Geometries of Mn(III) Spin Crossover Complexes

Occupied and virtual orbitals (CAM-B3LYP level of theory) giving the... |  Download Scientific Diagram
Occupied and virtual orbitals (CAM-B3LYP level of theory) giving the... | Download Scientific Diagram

Molecules | Free Full-Text | Designing Efficient Metal-Free Dye-Sensitized  Solar Cells: A Detailed Computational Study
Molecules | Free Full-Text | Designing Efficient Metal-Free Dye-Sensitized Solar Cells: A Detailed Computational Study

Simple computational chemistry: DFT advices
Simple computational chemistry: DFT advices

Tuned CAM-B3LYP functional in the time-dependent density functional theory  scheme for excitation energies and properties of diarylethene derivatives -  ScienceDirect
Tuned CAM-B3LYP functional in the time-dependent density functional theory scheme for excitation energies and properties of diarylethene derivatives - ScienceDirect

Studies of the Ground and Excited-State Surfaces of the Retinal Chromophore  using CAM-B3LYP | The Journal of Physical Chemistry B
Studies of the Ground and Excited-State Surfaces of the Retinal Chromophore using CAM-B3LYP | The Journal of Physical Chemistry B

Easy to Use DFT Approach for Computational pKa Determination of Carboxylic  Acids - Pezzola - 2024 - Chemistry – A European Journal - Wiley Online  Library
Easy to Use DFT Approach for Computational pKa Determination of Carboxylic Acids - Pezzola - 2024 - Chemistry – A European Journal - Wiley Online Library

Tuned CAM-B3LYP functional in the time-dependent density functional theory  scheme for excitation energies and properties of diarylethene derivatives -  ScienceDirect
Tuned CAM-B3LYP functional in the time-dependent density functional theory scheme for excitation energies and properties of diarylethene derivatives - ScienceDirect

Effect of Exchange–correlation Functionals on Ground State Geometries,  Optoelectronic and Charge Transfer of Triphenylamine-ba
Effect of Exchange–correlation Functionals on Ground State Geometries, Optoelectronic and Charge Transfer of Triphenylamine-ba

CAM-B3LYP Delivers Substantial Improvements to DFT and G0W0 Predictions of  Bandgap and Spectroscopic Properties of 2D and 3D Materials | Research NYU  Shanghai
CAM-B3LYP Delivers Substantial Improvements to DFT and G0W0 Predictions of Bandgap and Spectroscopic Properties of 2D and 3D Materials | Research NYU Shanghai

Molecules | Free Full-Text | A DFT Study on the Excited Electronic States  of Cyanopolyynes: Benchmarks and Applications
Molecules | Free Full-Text | A DFT Study on the Excited Electronic States of Cyanopolyynes: Benchmarks and Applications

Density Functional Theory for Charge Transfer: The Nature of the N-Bands of  Porphyrins and Chlorophylls Revealed through CAM-B3LYP, CASPT2, and SAC-CI  Calculations | The Journal of Physical Chemistry B
Density Functional Theory for Charge Transfer: The Nature of the N-Bands of Porphyrins and Chlorophylls Revealed through CAM-B3LYP, CASPT2, and SAC-CI Calculations | The Journal of Physical Chemistry B

Systematic study on the TD-DFT calculated electronic circular dichroism  spectra of chiral aromatic nitro compounds: A comparison of B3LYP and CAM- B3LYP - ScienceDirect
Systematic study on the TD-DFT calculated electronic circular dichroism spectra of chiral aromatic nitro compounds: A comparison of B3LYP and CAM- B3LYP - ScienceDirect

Full article: Experimental and theoretical DFT (B3LYP, X3LYP, CAM-B3LYP and  M06-2X) study on electronic structure, spectral features, hydrogen bonding  and solvent effects of 4-methylthiadiazole-5-carboxylic acid
Full article: Experimental and theoretical DFT (B3LYP, X3LYP, CAM-B3LYP and M06-2X) study on electronic structure, spectral features, hydrogen bonding and solvent effects of 4-methylthiadiazole-5-carboxylic acid

Importance of Dispersion in the Molecular Geometries of Mn(III) Spin  Crossover Complexes
Importance of Dispersion in the Molecular Geometries of Mn(III) Spin Crossover Complexes

NPA charges using the CAM-B3LYP-D3 method for the ground state in the... |  Download Scientific Diagram
NPA charges using the CAM-B3LYP-D3 method for the ground state in the... | Download Scientific Diagram

Plots of the CAM-B3LYP/6-311G(d,p) molecular orbitals contributing... |  Download Scientific Diagram
Plots of the CAM-B3LYP/6-311G(d,p) molecular orbitals contributing... | Download Scientific Diagram

The optimized geometry structure using DFT/CAM-B3LYP with the... | Download  Scientific Diagram
The optimized geometry structure using DFT/CAM-B3LYP with the... | Download Scientific Diagram

IJMS | Free Full-Text | Optical Properties of Silver-Mediated DNA from  Molecular Dynamics and Time Dependent Density Functional Theory
IJMS | Free Full-Text | Optical Properties of Silver-Mediated DNA from Molecular Dynamics and Time Dependent Density Functional Theory

Avaliação do funcional CAM-B3LYP e Pseudo-Potenciais pStuttgart no Cálculo  de Polarizabilidades Moleculares
Avaliação do funcional CAM-B3LYP e Pseudo-Potenciais pStuttgart no Cálculo de Polarizabilidades Moleculares

TD-DFT (CAM-B3LYP)/3-21G ECD spectra of (a) oligomers of different... |  Download Scientific Diagram
TD-DFT (CAM-B3LYP)/3-21G ECD spectra of (a) oligomers of different... | Download Scientific Diagram

Testing exchange–correlation functionals at fractional electron numbers |  Theoretical Chemistry Accounts
Testing exchange–correlation functionals at fractional electron numbers | Theoretical Chemistry Accounts