Chemical Physics

Papers
(The H4-Index of Chemical Physics is 25. The table below lists those papers that are above that threshold based on CrossRef citation counts [max. 250 papers]. The publications cover those that have been published in the past four years, i.e., from 2022-08-01 to 2026-08-01.)
ArticleCitations
Pressure-induce structural changes of 1,1-diamino-2-nitro-2-(1-amino-1H-tetrazol-5-yl) ethene: An insensitive FOX-7-like energetic materials117
A new ab initio potential energy surface and rovibrational spectra for the N2–N2O complex83
CeO2 nanosheets for high performance aqueous battery systems76
Blue luminescent properties of Ce3+/Gd3+ co-doped NaBaBO3 phosphors60
Thiapillar[5]arenes: Structures, Properties, and Host-Guest chemistry49
Integrated in silico-in vitro molecular modeling and design of halogenated phenylalanine-containing antihypertensive peptide inhibitors with halogen bonds to target human angiotensin-I-converting enzy48
Characterization of CZO thin films prepared by Sol – Gel dip coating technique with varied concentrations and annealed at different temperatures39
The effect of laser repetition rate in second harmonic generation imaging and intensity detection36
Vibrational spectra and ab initio investigations of CH3Br-water complexes isolated in neon matrix35
Contents continued34
The rate constant for the automerization of vinyl radical: A theoretical approach using the Complete Active Space Self Consistent Field method34
Rotational tunneling in molecular crystals revisited: Realization of pocket states34
Cross sections for elastic collisions of low-energy positrons with tetrachloroethylene (C34
Surface-active ionic liquids as drug carriers: A physico-chemical study33
Polymorphic behavior in isoniazid-4-hydroxybenzoic acid hydrated cocrystals: A combined terahertz, Raman vibrational spectroscopy, and DFT analysis33
Facile synthesis of thin, extra-straight silver nanowires via a novel single-step modification for high-performance SERS detection of thiram32
Molecular insights into acetonitrile-water separation by liquid-liquid extraction using water-choline chloride deep eutectic solvent32
Pressure-induced structural phase transitions and metallization in cuprous oxide under different hydrostatic environments up to 25.3 GPa30
Pseudocapacitive charge-storage properties of perovskite-based oxides Ca2-xSrxFeCoO6-δ (x = 0, 1)30
Free energy reconstruction/decomposition from WHAM, force integration and free energy perturbation for an umbrella sampling simulation29
Facilistic preparation of zinc oxide nanoarrays on nickel foam via a one-step chemical bath method for photocatalysis29
An Implementation of DMET-CCSD(T) in Water Clusters: Reduced Scaling and Quality of Relative Energies28
Global diabatic potential energy surfaces of the C2H system and dynamics studies of the C(3P) + CH → C2(X1Σ + g, a3Π) + H reaction27
First-principles study of electronic properties of multilayer palgraphyne and BN palgraphyne-like sheets27
Computational investigations of optoelectronic properties of K2ScAuX6 (X = Cl, Br) double perovskites for energy harvesting devices26
Investigation on structural, mechanical, electronic, vibrational, thermophysical, optic, and hydrogen storage properties of K2CaH4 under pressures from 0 to 15 GPa25
The photoelectric properties of 2D ZnO/black phosphorus heterostructures with different electric field25
Nernst slope and the constant surface charge density behind the ion adsorption-origin membrane potential25
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