Ahmet Altun

Loop profile ResearcherID Scopus Author ID ORCID

Publication Activity (10 Years)

Years Active: 2018-2023
Publications (10 Years): 12

Top Topics

Circulating Tumor Cells

Molecular Dynamics Simulations

Energy Transfer

Top Venues

Journal of chemical theory and computation

Journal of the American Chemical Society

Beilstein journal of organic chemistry

Chemistry (Weinheim an der Bergstrasse, Germany)

This page only lists publications with an associated author ORCID identifier.

Publications

Ahmet Altun, Christoph Riplinger, Frank Neese, Giovanni Bistoni
Exploring the Accuracy Limits of PNO-Based Local Coupled-Cluster Calculations for Transition-Metal Complexes. Journal of chemical theory and computation (2023)
Jan M Schümann, Lukas Ochmann, Jonathan Becker, Ahmet Altun, Ingolf Harden, Giovanni Bistoni, Peter Richard Schreiner
Exploring the Limits of Intramolecular London Dispersion Stabilization with Bulky Dispersion Energy Donors in Alkane Solution. Journal of the American Chemical Society 145 (4) (2023)
Jan M Schümann, Lukas Ochmann, Jonathan Becker, Ahmet Altun, Ingolf Harden, Giovanni Bistoni, Peter Richard Schreiner
Exploring the Limits of Intramolecular London Dispersion Stabilization with Bulky Dispersion Energy Donors in Alkane Solution. Journal of the American Chemical Society (2023)
Ahmet Altun, Frank Neese, Giovanni Bistoni
Open-Shell Variant of the London Dispersion-Corrected Hartree-Fock Method (HFLD) for the Quantification and Analysis of Noncovalent Interaction Energies. Journal of chemical theory and computation 18 (4) (2022)
Ahmet Altun, Miquel Garcia-Ratés, Frank Neese, Giovanni Bistoni
Unveiling the complex pattern of intermolecular interactions responsible for the stability of the DNA duplex. Chemical science 12 (38) (2021)
Ahmet Altun, Soumen Ghosh, Christoph Riplinger, Frank Neese, Giovanni Bistoni
Addressing the System-Size Dependence of the Local Approximation Error in Coupled-Cluster Calculations. The journal of physical chemistry. A 125 (45) (2021)
Ahmet Altun, Frank Neese, Giovanni Bistoni
Extrapolation to the Limit of a Complete Pair Natural Orbital Space in Local Coupled-Cluster Calculations. Journal of chemical theory and computation 16 (10) (2020)
Ahmet Altun, Masaaki Saitow, Frank Neese, Giovanni Bistoni
Local Energy Decomposition of Open-Shell Molecular Systems in the Domain-Based Local Pair Natural Orbital Coupled Cluster Framework. Journal of chemical theory and computation 15 (3) (2019)
Ahmet Altun, Frank Neese, Giovanni Bistoni
HFLD: A Nonempirical London Dispersion-Corrected Hartree-Fock Method for the Quantification and Analysis of Noncovalent Interaction Energies of Large Molecular Systems †. Journal of chemical theory and computation 15 (11) (2019)
Ahmet Altun, Frank Neese, Giovanni Bistoni
Local energy decomposition analysis of hydrogen-bonded dimers within a domain-based pair natural orbital coupled cluster study. Beilstein journal of organic chemistry 14 (2018)
Luong Phong Ho, Alexandre Nasr, Peter G Jones, Ahmet Altun, Frank Neese, Giovanni Bistoni, Matthias Tamm
London Dispersion Interactions in Pnictogen Cations [ECl2 ]+ and [E=E]2+ (E=P, As, Sb) Supported by Anionic N-Heterocyclic Carbenes. Chemistry (Weinheim an der Bergstrasse, Germany) 24 (71) (2018)
Ahmet Altun, Frank Neese, Giovanni Bistoni
Effect of Electron Correlation on Intermolecular Interactions: A Pair Natural Orbitals Coupled Cluster Based Local Energy Decomposition Study. Journal of chemical theory and computation 15 (1) (2018)