Improvement of the Optoelectronic Properties of Terazulene Molecules for Organic Solar Cell Applications Abdiulrsool H. AL-TaherLafy F. AL-BadryEbrahim Heidari Semiromi STRUCTURE OF CHEMICAL COMPOUNDS, QUANTUM CHEMISTRY, SPECTROSCOPY 08 December 2021 Pages: S1 - S5
EDA, CDA and QTAIM Investigations in the (para-C5H4X) Ir(PH3)3 Iridabenzene Complexes Gholamreza Ghane ShalmaniReza GhiasiAzam Marjani STRUCTURE OF CHEMICAL COMPOUNDS, QUANTUM CHEMISTRY, SPECTROSCOPY 08 December 2021 Pages: S6 - S13
Exploring of the Solvent Effect on the Electronic Structure and 14N NMR Chemical Shift of Cyclic-N3S3Cl3: A Computational Investigation Reza GhiasiNeda Najjari Milani STRUCTURE OF CHEMICAL COMPOUNDS, QUANTUM CHEMISTRY, SPECTROSCOPY 08 December 2021 Pages: S14 - S21
Optimized Molecular Geometries, Internal Coordinates, Vibrational Analysis, Thermodynamic Properties, First Hyperpolarizability and HOMO–LUMO Analysis of Duroquinone Using Density Functional Theory and Hartree–Fock Method Sarvendra KumarSurbhiM. K. Yadav STRUCTURE OF CHEMICAL COMPOUNDS, QUANTUM CHEMISTRY, SPECTROSCOPY 08 December 2021 Pages: S22 - S31
Monte Carlo Method and a Novel Modelling-Optimization Approach on QSAR Study of Doxazolidine Drugs and DNA-Binding Maria NikkarRobabeh SayyadikordAbadiGhasem Ghasemi STRUCTURE OF CHEMICAL COMPOUNDS, QUANTUM CHEMISTRY, SPECTROSCOPY 08 December 2021 Pages: S32 - S41
DFT Calculations and SEM–EDX Analysis of Copper(II)-Azide Complexes; [Cu(en)2(N3)2] and [Cu(Tmen)(N3)2]2 (Tmen = N,N,N',N'-Tetramethylethylenediamine) Abdul GhaffarSidra NawazSaeed Ahmad STRUCTURE OF CHEMICAL COMPOUNDS, QUANTUM CHEMISTRY, SPECTROSCOPY 08 December 2021 Pages: S42 - S51
Estimation of Pore Critical Temperature of Nanoconfined Alkanes Using Vapour-Liquid Interfacial Free Energy Naincy AttriSudhir K. Singh DYNAMICS OF PHASE TRANSITIONS 08 December 2021 Pages: S52 - S67
The CHSH Bell Inequality: A Critical Look at Its Mathematics and Some Consequences for Physical Chemistry Han GeurdesKoji NagataTadao Nakamura PHYSICAL METHODS FOR INVESTIGATION OF CHEMICAL PROCESSES 08 December 2021 Pages: S68 - S80
Abnormal Molecular Clusters in Pyridine-Ethanol Mixtures under Electric Fields Zhiyan WuLinqing ZhangYinhong Liao PHYSICAL METHODS FOR INVESTIGATION OF CHEMICAL PROCESSES 08 December 2021 Pages: S81 - S91
A Combined Experimental and Theoretical Investigation of Perylene Based Dyes as Sensitizer for Dye-Sensitized Solar Cell E. KaveryG. VinodhaMd. Maksudur Rahman Khan PHYSICAL METHODS FOR INVESTIGATION OF CHEMICAL PROCESSES 08 December 2021 Pages: S92 - S101
Preparation and Evaluation of Ammonium-Succinic Salts as Shale Swelling Inhibitor and Its Application in Water-Based Drilling Fluids Yuntian JingJie ZhangGang Chen CHEMICAL PHYSICS OF POLYMER MATERIALS 08 December 2021 Pages: S102 - S108
Preparation, Physicochemical and Rheological Studies of Stimuli-Responsive Biodegradable Polymer Gels Abbas KhanMuhammad SajjadMuhammad Humayun CHEMICAL PHYSICS OF POLYMER MATERIALS 08 December 2021 Pages: S109 - S119
Physical Properties of Au/Pd-on-glass Thin Films on Glasses Prepared by Electron Beam Evaporation Faezeh GhaderiFeridoun SamavatMaryam Kiani CHEMICAL PHYSICS OF NANO-MATERIALS 08 December 2021 Pages: S120 - S129
Dispersive Solid-Phase Extraction for Bromocresol Green Removal with β-Cyclodextrin Functionalized Magnetic Nanotubes Ali MoghimiMilad Abniki CHEMICAL PHYSICS OF NANO-MATERIALS 08 December 2021 Pages: S130 - S139
Increasing the Performance of Cathode Material in Alkaline (Li, Na and K) Ion Battersis: Synthesis and Characterization Samira BagheriMajid MonajjemiAfshin Taghvamanesh CHEMICAL PHYSICS OF NANO-MATERIALS 08 December 2021 Pages: S140 - S148