Maksim Kulichenko
Utah State University
H-index: 14
North America-United States
Top articles of Maksim Kulichenko
PYSEQM 2.0: GPU-Based Fast Semiempirical Mechanics for Ground and Excited States
2023/11/27
Nikita Fedik
H-Index: 11
Maksim Kulichenko
H-Index: 6
Synergy of semiempirical models and machine learning in computational chemistry
The Journal of Chemical Physics
2023/9/21
On the structures and bonding of copper boride nanoclusters, Cu2Bx–(x= 5–7)
Solid State Sciences
2023/8/1
NEXMD v2. 0 Software Package for Nonadiabatic Excited State Molecular Dynamics Simulations
Journal of Chemical Theory and Computation
2023/7/28
Photoelectron Spectroscopy and Theoretical Study of Di-Copper–Boron Clusters: Cu2B3– and Cu2B4–
The Journal of Physical Chemistry A
2023/5/26
Semi-empirical shadow molecular dynamics: A pytorch implementation
Journal of Chemical Theory and Computation
2023/5/10
Maksim Kulichenko
H-Index: 6
Nikita Fedik
H-Index: 11
Uncertainty-driven dynamics for active learning of interatomic potentials
Nature Computational Science
2023/3
Maksim Kulichenko
H-Index: 6
Extending machine learning beyond interatomic potentials for predicting molecular properties
2022/9
Probing copper-boron interactions in the Cu2B8− bimetallic cluster
Journal of Vacuum Science & Technology A
2022/7/1
Stability, Electronic Structure, and Nonlinear Optical Properties in Clusters and Materials: A Synergistic Experimental-Computational Analysis
2022
Maksim Kulichenko
H-Index: 6
2021 Virtual Theoretical Division Lightning Talk Series
2021/12/20
Bridging Aromatic/Antiaromatic Units: Recent Advances in Aromaticity and Antiaromaticity in Main‐Group and Transition‐Metal Clusters from Bonding and Magnetic Analyses
2021/11/8
Maksim Kulichenko
H-Index: 6
Nikita Fedik
H-Index: 11
Photoelectron Spectroscopy of Size-Selected Bismuth–Boron Clusters: BiBn– (n = 6–8)
The Journal of Physical Chemistry A
2021/8/2
The rise of neural networks for materials and chemical dynamics
The Journal of Physical Chemistry Letters
2021/7/1
Maksim Kulichenko
H-Index: 6
Nikita Fedik
H-Index: 11
Double σ-Aromaticity in a Planar Zinc-Doped Gold Cluster: Au9Zn–
The Journal of Physical Chemistry A
2021/5/20
Designing molecular electrides from defective unit cells of cubic alkaline earth oxides
The Journal of Physical Chemistry C
2021/4/21
Maksim Kulichenko
H-Index: 6
Spherical aromaticity in inorganic chemistry
2021/1/1
Maksim Kulichenko
H-Index: 6
Nikita Fedik
H-Index: 11
“Bottled” spiro-doubly aromatic trinuclear [Pd 2 Ru]+ complexes
Chemical Science
2021
Maksim Kulichenko
H-Index: 6
Nikita Fedik
H-Index: 11
Alvaro Muñoz-Castro
H-Index: 20
Giovanni Maestri
H-Index: 20
Periodic F-defects on the MgO surface as potential single-defect catalysts with non-linear optical properties
Chemical Physics
2020/4/1
Maksim Kulichenko
H-Index: 6
Nikita Fedik
H-Index: 11
σ-Aromaticity in the MoS2 Monolayer
The Journal of Physical Chemistry C
2020/2/23
Maksim Kulichenko
H-Index: 6
Co-Authors
