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Molecular Physics
An International Journal at the Interface Between Chemistry and Physics
Volume 119, 2021 - Issue 3
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Research Articles

Relativistic distance-based topological descriptors of Linde type A zeolites and their doped structures with very heavy elements

Micheal Arockiaraja Department of Mathematics, Loyola College, Chennai, IndiaORCID Iconhttps://orcid.org/0000-0002-4457-1046
ORCID Icon,
Joseph Clementb Department of Mathematics, School of Advanced Sciences, Vellore Institute of Technology, Vellore, IndiaCorrespondence[email protected]
ORCID Iconhttps://orcid.org/0000-0001-7797-6456
ORCID Icon,
Daniel Paulc Department of Mathematics, Sri Sairam Institute of Technology, Chennai, India
&
Krishnan Balasubramaniand School of Molecular Sciences, Arizona State University, Tempe, AZ, USA
Article: e1798529 | Received 06 Jun 2020, Accepted 14 Jul 2020, Published online: 06 Aug 2020

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Ali Ahmad, Ali N. A. Koam & Muhammad Azeem. (2023) Reverse-degree-based topological indices of fullerene cage networks. Molecular Physics 121:14.
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B. Saravanan, Savari Prabhu, M. Arulperumjothi, K. Julietraja & Muhammad Kamran Siddiqui. (2023) Molecular Structural Characterization of Supercorenene and Triangle-Shaped Discotic Graphene. Polycyclic Aromatic Compounds 43:3, pages 2080-2103.
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Tony Augustine, S. Roy, J. Sahaya Vijay, Jain Maria Thomas & P. Shanmugam. (2023) Topological study on degree based molecular descriptors of fullerene cages. Molecular Physics 121:4.
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Micheal Arockiaraj, Joseph Jency, Jessie Abraham, S. Ruth Julie Kavitha & Krishnan Balasubramanian. (2022) Two-dimensional coronene fractal structures: topological entropy measures, energetics, NMR and ESR spectroscopic patterns and existence of isentropic structures. Molecular Physics 120:11.
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Medha Itagi Huilgol, V. Sriram & Krishnan Balasubramanian. (2022) Structure–activity relations for antiepileptic drugs through omega polynomials and topological indices. Molecular Physics 120:3.
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S. Savithiri, S. Bharanidharan, P. Sugumar, A. Nelson & G. Rajarajan. Synthesis, spectral characterisations, biological evaluation, DFT calculation and molecular docking analysis of 3,5-diethyl-2,6-di(2-bromophenyl)piperidin-4-one picrate with topological indices studies. Molecular Physics 0:0.
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Articles from other publishers (24)

Jia-Bao Liu, Micheal Arockiaraj, Daniel Paul, Joseph Clement, Xuemei Zhao & Sushil Tigga. (2024) Degree Descriptors and Graph Entropy Quantities of Zeolite ACO. Current Organic Synthesis 21:3, pages 263-273.
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Kavin Jacob & Joseph Clement. (2024) Zeolite ATN: Topological characterization and predictive analysis on potential energies using entropy measures. Journal of Molecular Structure 1299, pages 137101.
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Kavin Jacob & Joseph Clement. (2024) Topological entropy characterization of zeolite EDI and its application in predicting molecular interactions. The European Physical Journal Plus 139:2.
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国灿 林. (2024) Research on Topological Indices of n-Dimension Polycyclic Aromatic Hydrocarbons Based on Cut Methods. Advances in Applied Mathematics 13:02, pages 692-703.
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Ali Khabyah, Ali Ahmad, Muhammad Azeem, Yasir Ahmad & Ali N A Koam. (2023) Reverse-degree-based topological indices of two-dimensional coronene fractal structures. Physica Scripta 99:1, pages 015216.
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Kexiang Xu, Jing Tian & Sandi Klavžar. (2023) New transmission irregular chemical graphs. Discrete Applied Mathematics 340, pages 286-295.
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Dan-Marian Joița, Mihaela Aurelia Tomescu & Lorentz Jäntschi. (2023) Counting Polynomials in Chemistry: Past, Present, and Perspectives. Symmetry 15:10, pages 1815.
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Micheal Arockiaraj, Daniel Paul, Muhammad Usman Ghani, Sushil Tigga & Yu-Ming Chu. (2023) Entropy structural characterization of zeolites BCT and DFT with bond-wise scaled comparison. Scientific Reports 13:1.
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Khalil Hadi Hakami, Ali Ahmad, Muhammad Azeem, Sadia Husain & Ali N. A. Koam. (2023) A study of two‐dimensional coronene fractal structures with M‐polynomials. International Journal of Quantum Chemistry 123:13.
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Jeyaraj Sahaya Vijay, Santiago Roy, Bheeter Charles Beromeo, Mohamad Nazri Husin, Tony Augustine, R.U. Gobithaasan & Michael Easuraja. (2023) Topological Properties and Entropy Calculations of Aluminophosphates. Mathematics 11:11, pages 2443.
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Mahdi Ghasemifard, Misagh Ghamari & Meisam Iziy. (2023) Study of electron band structure of Pr doped ZnAl2O4 by reducing background in modified-CDB-spectroscopy. Radiation Physics and Chemistry 206, pages 110800.
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Ramy Shaheen, Suhail Mahfud & Qays Alhawat. (2023) Chromatic Schultz and Gutman Polynomials of Jahangir Graphs and . Journal of Applied Mathematics 2023, pages 1-13.
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Micheal Arockiaraj, J. Celin Fiona, S. Ruth Julie Kavitha, Arul Jeya Shalini & Krishnan Balasubramanian. (2022) Topological and Spectral Properties of Wavy Zigzag Nanoribbons. Molecules 28:1, pages 152.
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Micheal Arockiaraj, Daniel Paul, Sandi Klavžar, Joseph Clement, Sushil Tigga & Krishnan Balasubramanian. (2022) Relativistic topological and spectral characteristics of zeolite SAS structures. Journal of Molecular Structure 1270, pages 133854.
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Daniel Paul, Micheal Arockiaraj, Sushil Tigga & Krishnan Balasubramanian. (2022) Zeolite AST: Relativistic degree and distance based topological descriptors. Computational and Theoretical Chemistry 1218, pages 113933.
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Muhammad Javaid, Aqsa Sattar & Ebenezer Bonyah. (2022) Topological Aspects of Molecular Networks: Crystal Cubic Carbons. Complexity 2022, pages 1-14.
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Juanjuan Lu, Linli Zhu & Wei Gao. (2022) Cyclic connectivity index of bipolar fuzzy incidence graph. Open Chemistry 20:1, pages 331-341.
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Jessie Abraham, Micheal Arockiaraj, Joseph Jency, S. Ruth Julie Kavitha & Krishnan Balasubramanian. (2022) Graph entropies, enumeration of circuits, walks and topological properties of three classes of isoreticular metal organic frameworks. Journal of Mathematical Chemistry 60:4, pages 695-732.
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Micheal Arockiaraj, Daniel Paul, Sandi Klavžar, Joseph Clement, Sushil Tigga & Krishnan Balasubramanian. (2022) Relativistic distance based and bond additive topological descriptors of zeolite RHO materials. Journal of Molecular Structure 1250, pages 131798.
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Krishnan Balasubramanian. (2021) Symmetry and Combinatorial Concepts for Cyclopolyarenes, Nanotubes and 2D-Sheets: Enumerations, Isomers, Structures Spectra & Properties. Symmetry 14:1, pages 34.
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Krishnan Balasubramanian. (2021) Symmetry, Combinatorics, Artificial Intelligence, Music and Spectroscopy. Symmetry 13:10, pages 1850.
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Akbar Ali & Tomislav Došlić. (2021) Mostar index: Results and perspectives. Applied Mathematics and Computation 404, pages 126245.
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Shehnaz Akhter, Zahid Iqbal, Adnan Aslam & Wei Gao. (2021) Computation of Mostar index for some graph operations. International Journal of Quantum Chemistry 121:15.
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Fouad A. Abolaban, Ali Ahmad & Muhammad Ahsan Asim. (2021) Computation of Vertex-Edge Degree Based Topological Descriptors for Metal Trihalides Network. IEEE Access 9, pages 65330-65339.
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