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Nagy Ágnes

Publication list

Uploaded publications:
235
Publications in DEA:
182
OA:
70
Date range:
1984-2025
2025
1.
Nagy, Á.: Density functional theory: Preliminaries, extensions to excited states, statistical and information concepts.
Advances in Quantum Chemistry. 1-28, 2025.
2.
Nagy, Á.: Ensemble density functional theory with spherically symmetric densities.
J. Chem. Phys. 162 (17), 1-21, (article identifier: 174109), 2025.
Journal metrics:
Q2 Medicine (miscellaneous) (2024)
Q1 Physical and Theoretical Chemistry (2024)
Q1 Physics and Astronomy (miscellaneous) (2024)
3.
Nagy, Á.: Fisher Information Density Functional Theory.
J. Comput. Chem. 46 (23), 1-6, (article identifier: 70215), 2025.
Journal metrics:
Q1 Chemistry (miscellaneous) (2024)
Q1 Computational Mathematics (2024)
4.
Nagy, Á.: Phase-space Fisher information and Rényi entropy in the thermodynamic scheme of density functional theory.
J.Chemical Sciences. 137 (4), 1-6, (article identifier: 87), 2025.
Journal metrics:
Q3 Chemistry (miscellaneous) (2024)
2024
5.
Nagy, Á.: Density functional theory from spherically symmetric densities: Ground and excited states of Coulomb systems.
J. Chem. Phys. 161 (4), 1-21, (article identifier: 044120), 2024.
Journal metrics:
Q2 Medicine (miscellaneous)
Q1 Physical and Theoretical Chemistry
Q1 Physics and Astronomy (miscellaneous)
6.
Nagy, Á.: Phase-space relative Rényi entropy in density functional theory.
Int. J. Quantum Chem. 124 (1), 1-8, (article identifier: 27226), 2024.
Journal metrics:
Q3 Atomic and Molecular Physics, and Optics
Q3 Condensed Matter Physics
Q3 Physical and Theoretical Chemistry
2023
7.
Nagy, Á.: Excited-state density functional theory.
In: Chemical Reactivity Volume 1: Theories and Principles / Savas Kaya, Laszlo von Szentpaly, Goncagul Serdaroglu, Lei Guo, Elsevier, Amsterdam, 251-261, 2023. ISBN: 9780323902571
8.
Nagy, Á.: Spherical densities and potentials in exactly solvable model molecules.
J. Chem. Phys. 159 (14), 1-16, (article identifier: 144101), 2023.
Journal metrics:
Q1 Medicine (miscellaneous)
Q1 Physical and Theoretical Chemistry
Q1 Physics and Astronomy (miscellaneous)
9.
Nagy, Á.: Spherical Subspace Potential Functional Theory.
Computation. 11 (6), 1-15, (article identifier: 119), 2023.
Journal metrics:
Q3 Theoretical Computer Science
Q3 Applied Mathematics
Q2 Computer Science (miscellaneous)
Q3 Modeling and Simulation
2022
10.
Nagy, Á., Sen, K. D.: Nuclear cusp and critical nuclear charge.
Mol. Phys. 121, e2131643, (article identifier: 2131643), 2022.
Journal metrics:
Q3 Biophysics
Q3 Condensed Matter Physics
Q4 Molecular Biology
Q3 Physical and Theoretical Chemistry
11.
Nagy, Á.: Orbital-free spherical density functional theory.
Lett. Math. Phys. 112 (5), 112-107, 2022.
Journal metrics:
Q2 Mathematical Physics
Q2 Statistical and Nonlinear Physics
12.
Nagy, Á.: Phase-space Rényi entropy, complexity and thermodynamic picture of density functional theory.
J. Math. Chem. 61, 2022.
Journal metrics:
Q2 Applied Mathematics
Q2 Chemistry (miscellaneous)
2021
13.
Nagy, Á.: Density Functional Theory of Coulombic Excited States Based on Nodal Variational Principle.
Computation. 9 (8), 1-6, (article identifier: 93), 2021.
Journal metrics:
Q3 Applied Mathematics
Q2 Computer Science (miscellaneous)
Q3 Modeling and Simulation
Q3 Theoretical Computer Science
14.
Nagy, Á.: Density Functional Theory of Highly Excited States of Coulomb Systems.
Computation. 9 (6), 1-12, (article identifier: 73), 2021.
Journal metrics:
Q3 Applied Mathematics
Q2 Computer Science (miscellaneous)
Q3 Modeling and Simulation
Q3 Theoretical Computer Science
15.
Nagy, Á.: Fisher information and density functional theory.
Int. J. Quantum Chem. [Epub ahead of print], 1-18, 2021.
Journal metrics:
Q2 Atomic and Molecular Physics, and Optics
Q2 Condensed Matter Physics
Q2 Physical and Theoretical Chemistry
16.
Nagy, Á.: Subspace theory with spherically symmetric densities.
J. Chem. Phys. 154 (7), 1-18, (article identifier: 074103), 2021.
Journal metrics:
Q1 Medicine (miscellaneous)
Q1 Physical and Theoretical Chemistry
Q1 Physics and Astronomy (miscellaneous)
2020
17.
Nagy, Á.: Information theoretical and thermodynamic view of the excited-state density functional theory of Coulomb systems.
J. Chem. Phys. 153 (15), 1-16, (article identifier: 154103), 2020.
Journal metrics:
Q1 Medicine (miscellaneous)
Q1 Physical and Theoretical Chemistry
Q1 Physics and Astronomy (miscellaneous)
18.
Nagy, Á.: Relative information in excited-state orbital-free density functional theory.
Int. J. Quantum Chem. 120 (23), 1-10, (article identifier: 26405), 2020.
Journal metrics:
Q2 Atomic and Molecular Physics, and Optics
Q2 Condensed Matter Physics
Q3 Physical and Theoretical Chemistry
19.
Nagy, Á.: Spherical Density Functional Theory and Atoms in Molecules.
J. Phys. Chem. A. 124 (1), 148-151, 2020.
Journal metrics:
Q2 Medicine (miscellaneous)
Q2 Physical and Theoretical Chemistry
2019
20.
Nagy, Á.: A thermal orbital-free density functional approach.
J. Chem. Phys. 151 (1), 1-12, (article identifier: 014103), 2019.
Journal metrics:
Q1 Medicine (miscellaneous)
Q1 Physical and Theoretical Chemistry
Q1 Physics and Astronomy (miscellaneous)
21.
Nagy, Á.: Coordinate Scaling in Time-Independent Excited-State Density Functional Theory for Coulomb Systems.
Computation. 7 (4), 1-6, (article identifier: 59), 2019.
Journal metrics:
Q3 Applied Mathematics
Q2 Computer Science (miscellaneous)
Q3 Modeling and Simulation
Q3 Theoretical Computer Science
22.
Tian, L. Y., Levämäki, H., Kuisma, M., Kokko, K., Nagy, Á., Vitos, L.: Density functional theory description of random Cu-Au alloys.
Phys. Rev. B. 99 (6), 1-9, (article identifier: 064202), 2019.
Journal metrics:
D1 Condensed Matter Physics
D1 Electronic, Optical and Magnetic Materials
23.
Tian, L. Y., Levämäki, H., Eriksson, O., Kokko, K., Nagy, Á., Délczeg-Czirják, E. K., Vitos, L.: Density Functional Theory description of the order-disorder transformation in Fe-Ni.
Sci. Rep. 9 (1), 1-7, (article identifier: 8172), 2019.
Journal metrics:
D1 Multidisciplinary
24.
Nagy, Á.: Gerjesztett állapotok sűrűségfunkcionál-elmélete.
Magy. Kém. F. 125 (3), 123-129, 2019.
25.
Bolívar, J. C., Nagy, Á., Romera, E.: Phase-space Fisher information of 2D gapped Dirac materials.
J. Math. Chem. 57 (4), 1169-1180, 2019.
Journal metrics:
Q3 Applied Mathematics
Q3 Chemistry (miscellaneous)
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