Rafizah Rahamathullah
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Preferred name
Rafizah Rahamathullah
Official Name
Rafizah, Rahamathullah
Alternative Name
Rahamathulla, Rafizah
Rahamathullah, R.
Main Affiliation
Scopus Author ID
55764144700
Researcher ID
DMZ-6313-2022

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The structure-property studies and mechanism of optical limiting action of methyl 4-((4-aminophenyl)ethynyl)benzoate crystal under continuous wave laser excitation

2020 , Muhamad Fikri Zaini , Wan Mohd Khairul , Suhana Arshad , Mundzir Abdullah , Dian Alwani Zainuri , Rafizah Rahamathullah , Muhammad Izz Rosli , Muhammad Safwan Abd Aziz , Ibrahim Abdul Razak

This study focuses on the design of the new dye of donor-π-acceptor (D−π−A) system of methyl 4-((4-aminophenyl)ethynyl)benzoate (MAPEB) to highlight its structural-property relation through a combined experimental and quantum chemical calculation approaches for optical limiting applications. MAPEB was synthesized via aerobic condition palladium-catalysed Sonogashira cross-coupling reaction with good yield. This molecular structure was confirmed by single crystal X-ray crystallographic analysis and the crystal exhibits monoclinic non-centrosymmetric space group of Pc. The existence of intermolecular interactions was confirmed by Hirshfeld analysis, showing high contribution of C⋯H contact which suggested the high nonlinear optical response of the compound. The experimental spectroscopic data including Fourier Transform Infrared (FT-IR), 1H and 13C Nuclear Magnetic Resonance, electronic absorption spectra, HOMO-LUMO energy gap were compared with Density Functional Theory (DFT) at 6–311++G (d,p) basis set. The experimental results complement the theoretical findings in supporting anticipated electronic properties of the molecule. Additionally, the z-scan analysis unveils an excellent value of χ3 of MAPEB in the order of 10−6 esu which indicate good nonlinear optical material under 532 nm continuous wave laser. Low optical limiting action was measured at 110 kW/cm2 which is suitable for various continuous wave laser applications. These findings prove that MAPEB has the potential to be employed as NLO materials for photonic applications.

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The experimental and DFT approaches on electronic, thermal and conductivity properties of non-linear optical bearing fused aromatic chalcones towards prospective OLEDs

2025-01 , Wan M. Khairul , Anisatul Aqidah Tagiling , Ain Qarina Muzaman , Rafizah Rahamathullah , Mas Mohammed , Syaharil Saidin , Suhana Arshad , Ibrahim Abdul Razak , Fazira Ilyana Abdul Razak , Suhaila Sapari

New derivatives of push-pull chalcone was successfully synthesized to demonstrate as NLO active on the impact of organic light emitting diode (OLED) materials. A total of three fused-aromatic chalcones (AA, AB, AC) with different substituents have been characterized through TGA, Z-scan analysis, 1H & 13C NMR, IR and UV–Vis. All the targeted compounds are nonlinear refraction (NLR) active with the range of χ(3) (∼ × 10–6 esu). AC reveals the highest value of first order hyperpolarizability (βtot) at 528.08 × 10–30 esu upon the substitution of strong electron acceptor. Theoretical investigation was performed by employing the theory of B3LYP/6–31 G (d,p) level via density functional theory (DFT) to optimize the geometries, molecular electrostatic potential (MEP) and frontier molecular orbitals (FMO). The predicted electronic properties of the molecule are supported by the experimental results, confirming the theoretical conclusions. The examination of its potential as emissive layer in OLED application was constructed on ITO substrate for electroluminescence behaviour evaluation under various direct current (DC) voltages supply. The preliminary outcomes reveal that these simple chalcone derivatives are capable of being utilised in any optoelectronic application.

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Deciphering ethynyl single crystal for NLO applications: Synergistic studies on the structural, Hirshfeld surface, photophysical and DFT assessment

2024 , Wan M. Khairul , Mas Mohammed , Rafizah Rahamathullah , Muhamad Fikri Zaini , Suhana Arshad , Abdul Razak Ibrahim , Fazira Ilyana Abdul Razak , Suhaila Sapari

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