Amir Karton
Orcid: 0000-0002-7981-508X
According to our database1,
Amir Karton
authored at least 12 papers
between 2015 and 2022.
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Bibliography
2022
J. Comput. Chem., 2022
Assessment of DLPNO-CCSD(T)-F12 and its use for the formulation of the low-cost and reliable L-W1X composite method.
J. Comput. Chem., 2022
2021
Thermochemical stabilities of giant fullerenes using density functional tight binding theory and isodesmic-type reactions.
J. Comput. Chem., 2021
Evaluation of density functional theory for a large and diverse set of organic and inorganic equilibrium structures.
J. Comput. Chem., 2021
2020
Kinetics and Thermodynamics of Reactions Involving Criegee Intermediates: An Assessment of Density Functional Theory and Ab Initio Methods Through Comparison with CCSDT(Q)/CBS Data.
J. Comput. Chem., 2020
2019
A computational foray into the mechanism and catalysis of the adduct formation reaction of guanine with crotonaldehyde.
J. Comput. Chem., 2019
2017
W4-17: A diverse and high-confidence dataset of atomization energies for benchmarking high-level electronic structure methods.
J. Comput. Chem., 2017
How reliable is DFT in predicting relative energies of polycyclic aromatic hydrocarbon isomers? comparison of functionals from different rungs of jacob's ladder.
J. Comput. Chem., 2017
J. Comput. Aided Mol. Des., 2017
2016
Heats of formation of platonic hydrocarbon cages by means of high-level thermochemical procedures.
J. Comput. Chem., 2016
2015
Accurate reaction barrier heights of pericyclic reactions: Surprisingly large deviations for the CBS-QB3 composite method and their consequences in DFT benchmark studies.
J. Comput. Chem., 2015