Sr# |
Authors |
Paper Title |
Journal |
Page# |
Pub. Year |
Volume# |
Impact Factor |
HEC Rec. |
View |
1 |
M.R.S.A. Janjua*, W. Guan, L.K. Yan, Z.M. Su |
Role of terminal positions of aryl ring towards second-order nonlinearity in arylimido-substituted molybdates: An interesting quantum study of organic-inorganic hybrid composites |
Curr. Phys. Chem. |
99-105 |
2011 |
1 |
.225 |
|
|
2 |
M.R.S.A. Janjua*, Z.M. Su, W. Guan, C.G. Liu, L.K. Yan, P. Song, G. Maheen |
Tuning second-order non-linear (NLO) optical response of organoimido-substituted hexamolybdates through halogens: Quantum design of novel organic-inorganic hybrid NLO materials |
Aust. J. Chem. |
836-844 |
2010 |
63 |
1.681 |
|
|
3 |
M.R.S.A. Janjua*, W. Guan, C.G. Liu, S. Muhammad, L.K. Yan, Z.M. Su |
A quantum mechanical study of the second-order nonlinear optical properties of aryldiazenido-substituted hexamolybdates: A surprising charge transfer |
Eur. J. Inorg. Chem |
5181-5188 |
2009 |
2009 |
2.941 |
|
|
4 |
M. U. Khan, M. Ibrahima, M. Khalid, S. Jamil, A. A. Al-Saadi, M.R.S.A. Janjua* |
Quantum chemical designing of indolo[3,2,1-jk]carbazole-based dyes for highly efficient nonlinear optical properties |
Chem. Phys. Lett. |
59���66 |
2019 |
719 |
2.029 |
|
|
5 |
S. R. Khan, S.Abid, S. Jamil, A. I. Aqib,M. N. Faisal, M.R.S.A. Janjua |
Layer by Layer Assembly of Zinc Oxide Nanotubes and Nanoflowers as Catalyst for Separate and Simultaneous Catalytic Degradation of Dyes and Fuel Additive |
Chemistry Select. |
5548???555 |
2019 |
4 |
1.811 |
|
|
6 |
C. C. Nnadiekwe, A. Nada, I. Abdulazeez, M. R. Imam, M.R.S.A. Janjua A. A. Al-Saadi |
UV-absorbing benzamide-based dendrimer precursors: synthesis, theoretical calculation, and spectroscopic characterization |
New J. Chem. |
75-85 |
2022 |
46 |
3.591 |
|
|
7 |
T. Mubashir, M.H.Tahir, M.H.H. Mahmoud, Z. Shafiq, M. Ashraf, I.H. El. Azab, Z.M. El-Bahy, M.R.S.A. Janjua* |
Designing of symmetric and asymmetric small molecule acceptors for organic solar cells: A farmwork based on Machine learning, virtual screening and structural analysis |
J. Photochem. Photobiol. A |
114977 |
2023 |
444 |
5.141 |
|
|
8 |
M. Haroon, A. A. Al-Saadi, M.R.S.A. Janjua* |
Insights into end-capped modifications effect on the photovoltaic and optoelectronic properties of S-shaped fullerene-free acceptor molecules: A density functional theory computational study for organic solar cells |
J. Phys. Org. Chem. |
e4314 |
2022 |
35 |
2.391 |
|
|
9 |
M.R.S.A Janjua, A Irfan, M Hussien, M Ali, M Saqib, M Sulaman |
Machine���Learning Analysis of Small���Molecule Donors for Fullerene Based Organic Solar Cells |
Energy Technol. |
2200019 |
2022 |
10 |
3.631 |
|
|
10 |
M Haroon, W. Fatima, M.R.S.A. Janjua* |
Physicochemical insights into the rational designing of new acceptor molecules by donor bridge modifications for efficient solar cells: In silico chemistry |
J. Phys. Org. Chem. |
e4399 |
2022 |
35 |
2.155 |
|
|
11 |
M. Amin, F. Anwar, M.R.S.A. Janjua, M.A. Iqbal, U. Rashid |
Green synthesis of silver nanoparticles through reduction with Solanum xanthocarpum L. Berry extract: Characterization, antimicrobial and urease inhibitory activities against Helicobacter pylori |
Int. J. Mol. Sci. |
9923-9941 |
2012 |
13 |
2.464 |
|
|
12 |
M.R.S.A. Janjua* |
Nonlinear optical response of a series of small molecules: quantum modification of ��-spacer and acceptor |
J. Iran. Chem. Soc. |
2041���2054 |
2017 |
14 |
1.593 |
|
|
13 |
S. R. Khan, S. Jamil, M. Mustaqeem, M.R.S.A. Janjua* |
Template Free Synthesis of Calcium-Tin (CaSn3) Bimetallic Micro Cubes: Characterization, Catalytic Activity, Adsorption and Additive Properties |
Chem. Phys. Lett. |
136917 |
2020 |
739 |
2.328 |
|
|
14 |
S. Sarfraz, S. Ali, S. A. Khan, K. H. Shah, S. Amin, M. Mujahid, S. Jamil, M.R.S.A. Janjua |
Phase diagram and surface adsorption behavior of benzyl dimethyl hexadecyl ammonium bromide in a binary surfactant-water system |
J. Mol. Liq. |
403���407 |
2019 |
285 |
5.065 |
|
|
15 |
M.R.S.A. Janjua* |
M. U. Khan, M. Khalid, N. Ullah, R. Kalgaonkar, K. Alnoaimi, N. Baqader, S. Jamil, Theoretical and Conceptual Framework to Design Efficient Dye-Sensitized Solar Cells (DSSCs): Molecular Engineering by DFT Method |
J. Clust. Sci. |
243���253. |
2021 |
32 |
3.061 |
|
|
16 |
I. Shahbaz, S. Jamil, S. Bibi, S.R. Khan, and M.R.S.A. Janjua* |
Recent Advances in Morphologically Controlled Synthesis of Graphene Oxide Based Nanocomposite as Catalyst and Fuel Additive |
J. Phys. Org. Chem. |
e4409 |
2022 |
35 |
2.155 |
|
|
17 |
M.R.S.A. Janjua* |
Photovoltaic properties and enhancement in near-infrared light absorption capabilities of acceptor materials for organic solar cell applications: A quantum chemical perspective via DFT |
J. Phys. Chem. Solids |
110996 |
2022 |
171 |
4.383 |
|
|
18 |
S. Jamil, A.R. Alvi, S. Bibi, N. Jahan, S.A.R. Naqvi, S.R. Khan, K.M. Zia, M.R.S.A. Janjua* |
Synthesis, characterization, and applications of cobalt bismuth layered double hydroxide nanoparticles: Physical insights towards a potential material as fuel additive and photocatalyst |
J. Phys. Org. Chem, |
e4500 |
2023 |
36 |
2.155 |
|
|
19 |
M.R.S.A. Janjua*, R. Mahmood*, M. Haroon, F. Anwar, M.U. Khan, N. Ullah |
In Silico Modelling of Viscoelastic Surfactants: Towards NLO Response and Novel Physical Insights through Bridging Acceptor |
J. Clust. Sci. |
519-528 |
2021 |
33 |
3.061 |
|
|
20 |
M. Haroon, M.R.S.A. Janjua* |
Prediction of NLO response of substituted organoimido hexamolybedate: First theoretical framework based on p-anisidine adduct [Mo6O18 (p-MeOC6H4N)]-2 |
Mater. Today Commun. |
101880 |
2021 |
26 |
3.383 |
|
|
21 |
S. Jamil, T. Tariq, S.R. Khan, M. A. Ehsan, A. Rehman, M.R.S.A. Janjua* |
Structural Characterization, Synthesis and Application of Zincite Nanoparticles as Fuel Additive |
J. Clust. Sc. |
1165���1176 |
2022 |
33 |
3.061 |
|
|
22 |
S. Jamil, S.R. Khan, S. Bibi, N. Jahan, N. Mushtaq, F. Rafaqat, R.A. Khan, W.A. Gill, M.R.S.A. Janjua* |
Recent advances in synthesis and characterization of iron���nickel bimetallic nanoparticles and their applications as photo-catalyst and fuel additive, |
RSC Adv. |
29632-29644. |
2023 |
13 |
3.9 |
|
|
23 |
S. Jamil, R. Afzal, S.R. Khan, M. Shabbir, N. Alhokbany, S. Li, M.R. S.A. Janjua* |
Photocatalytic degradation of indigo carmine dye by hydrothermally synthesized graphene nanodots (GNDs): investigation of kinetics and thermodynamics |
RSC Adv. |
23973-23986 |
2024 |
14 |
3.9 |
|
|
24 |
M.R.S.A. Janjua* |
Deciphering the role of invited guest bridges in non-fullerene acceptor materials for high performance organic solar cells |
Synth. Met. |
116865 |
2021 |
279 |
3.266 |
|
|
25 |
M.R.S.A. Janjua* |
Theoretical Framework for Encapsulation of Inorganic B12N12 Nanoclusters with Alkaline Earth Metals for Efficient Hydrogen Adsorption: A Step Forward toward Hydrogen Storage Materials |
Inorg. Chem. |
2816-2828 |
2021 |
60 |
5.165 |
|
|
26 |
M.R.S.A. Janjua* |
Prediction and Understanding: Quantum Chemical Framework of Transition Metals Enclosed in a B12N12 Inorganic Nanocluster for Adsorption and Removal of DDT from the Environment |
Inorg. Chem. |
10837���10847 |
2021 |
60 |
5.165 |
|
|
27 |
L. Kiran, M.H. Ijaz, Z.I Zaki, M.E Khalifa, Z. Shafiq, Z. Zubair, N. Sultan, M.R.S.A. Janjua* |
Data driven design of dyes with high dielectric constant for efficient optoelectronics |
J. Solid State Chem. |
125169 |
2025 |
343 |
3.2 |
|
|
28 |
M. Y. Mehboob, R. Zaier, R. Hussain, M. A. Malik, M. A. Iqbal, Z. Irshad, I. Bilal, M.R.S.A. Janjua* |
In Silico Modelling of Acceptor Materials by End-capped and ��-linker modifications for High Performance Organic Solar Cells: Estimated PCE > 18% |
Comp. Theor. Chem. |
113555 |
2022 |
1208 |
1.926 |
|
|
29 |
M.R.S.A. Janjua* |
Quantum Design of Transition Metals Decorated on Boron Phosphide Inorganic Nanocluster for Favipiravir Adsorption: A Possible Treatment for Covid-19 |
New J. Chem. |
1720-1730 |
2022 |
46 |
3.591 |
|
|
30 |
M.B. Zeshan, N. Sultana, M. I. Tariq. S. Jamil and M.R.S.A. Janjua* |
Physicochemical insights and in silico designing of new fullerene-free acceptor molecules for highly efficient and stable organic solar cells |
J. Phys. Chem. Solids |
110842 |
2022 |
169 |
4.383 |
|
|
31 |
M.R.S.A. Janjua* |
Quantum mechanical design of efficient second-order nonlinear optical materials based on heteroaromatics imido-substituted hexamolybdates: First theoretical framework of POM-based heterocyclic aromatic rings |
Inorg. Chem. |
11306-11314 |
2012 |
51 |
4.593 |
|
|
32 |
B. Zhu, Z.L. Lang, L. K. Yan, M.R.S.A. Janjua, Z.M. Su |
Comparative DFT study on mechanism of olefins epoxidation catalyzed by substituted binuclear peroxotungstates ([SeO4WO(O2)2MO(O2)2]n- (M ="" TiIV, VV, TaV, MoVI, WVI, TcVII, and ReVII)), |
Int. J. Quant. Chem. |
458-462 |
2014 |
114 |
1.432 |
|
|
33 |
N. Asghar, S.A.R. Naqvi, Z. Hussain, N. Rasool, Z.A. Khan, S.A. Shahzad, T.A. Sherazi, M.R.S.A. Janjua, S.A Nagra, M. Zia Ul Haq, H.Z Jaafar |
Compositional difference in antioxidant and antibacterial activity of all parts of the Carica papaya using different solvents |
Chem. Cent. J. |
2-11 |
2016 |
10 |
2.442 |
|
|
34 |
M. Haroon, S. Jamil, M.B. Zeshan, N. Sultana, M.I. Tariq, M.R.S.A. Janjua*, |
Photovoltaic Properties of Hole Transport Materials for Organic Solar Cells (OSCs) Applications: Physiochemical Insight and In Silico Designing |
Aust. J. Chem. |
399-411 |
2022 |
75 |
1.224 |
|
|
35 |
M.Y. Mehboob, R. Hussain, F. Younas, S. Jamil, M.M.A. Iqbal, K. Ayub, N. Sultana, M.R.S.A. Janjua* |
Computation Assisted Design and Prediction of Alkali-Metal-Centered B12N12 Nanoclusters for Efficient H2 Adsorption: New Hydrogen Storage Materials |
J. Clust. Sc. |
1237-1247. |
2022 |
34 |
3.447 |
|
|
36 |
M.I. Abdullah, M.R.S.A. Janjua, M.F. Nazar, A. Mahmood |
Quantum chemical designing of efficient TC4 based sensitizers by modification of auxiliary donor and ��-spacer |
Bull. Chem. Soc. Jpn. |
1272-1281 |
2013 |
86 |
2.222 |
|
|
37 |
M. Amin, A. Shah, M.R.S.A. Janjua |
In Vitro and In Vivo Anti-Helicobacter Pylori Activities of Zinc Amoxicillin Complex: A Comparative Evaluation with Some Standard Antibiotics Used In Multiple Therapy, |
World J. Pharm. Pharm. Sci |
75-88 |
2014 |
3 |
8.02 |
|
|
38 |
M.R.S.A. Janjua*, S. Jamil, N. Jahan, S.R. Khan, S. Mirza |
Morphologically controlled synthesis of ferric oxide nano/micro particles and their catalytic application in dry and wet media: a new approach |
Chem. Cent. J. |
1-14 |
2017 |
11 |
2.284 |
|
|
39 |
S. Jamil, G. Zahra and M.R.S.A. Janjua* |
Morphologically controlled synthesis, characterization, and applications of molybdenum oxide (MoO3) nanoparticles |
J. Phys. Org. Chem. |
e4477 |
2023 |
36 |
2.155 |
|
|
40 |
N. Sultana, M. Sarfraz, S. Akram, U. Rashid, S.A.R. Naqvi, M.I. Tariq, K.M. Zia, M.R.S.A. Janjua* |
Reactivity of 2, 2���disubstituted quinazolinone towards electrophilic substitution: First in silico design to verify experimental evidence of quinazolinone���based new organic compounds |
J. Phys. Org. Chem. |
e4488 |
2023 |
36 |
2.155 |
|
|
41 |
A. Mahmood, S. U. Khan, U. A. Rana, M.R.S.A. Janjua, M. H. Tahir, M. F. Nazar and Y. Song |
Effect of thiophene rings on UV/visible spectra and non-linear optical (NLO) properties of triphenylamine based dyes: A quantum chemical perspective |
J. Phys. Org. Chem. |
418-422 |
2015 |
28 |
1.515 |
|
|
42 |
S. Jamil, M.R.S.A. Janjua* |
Synthetic Study and Merits of Fe3O4 Nanoparticles as Emerging Material |
J. Clust. Sci. |
2369���2400 |
2017 |
28 |
1.715 |
|
|
43 |
A. R. Raza*, A. Sultan, N. Ullah, M.R.S.A. Janjua, K. M. Khan |
Fragmentation Study of Substituted Chalcones: Gas Phase Formation of Benz-1-oxin Cation |
Mod. Chem. Appl |
1000173 |
2016 |
4 |
1.37 |
|
|
44 |
M.Y. Mehboob, R. Hussain, F. Younas, S. Jamil, M.M.A. Iqbal, K. Ayub, N. Sultana, M.R.S.A. Janjua* |
Computation assisted design and prediction of alkali-metal-centered B12N12 nanoclusters for efficient H2 adsorption: New hydrogen storage materials |
J. Clust. Sci. |
1237-1247 |
2023 |
34 |
3.447 |
|
|
45 |
M.U. Khan, M.R.S.A. Janjua, J. Yaqoob, R. Hussain, M. Khalid, A. Syed, A.M. Elgorban, N.S.S. Zaghloul |
First theoretical framework of superalkali metals [M3X (M="" Li, Na, k; X="" O, S, F, N)] doped all-boron B38 nanocluster: A promising class of nonlinear optical materials for optoelectronic applications |
J. Photochem. Photobiol. A |
114667 |
2023 |
440 |
5.141 |
|
|
46 |
M.R.S.A. Janjua* |
Computational Study on Non-linear Optical and Absorption Properties of Benzothiazole based Dyes: Tunable Electron-Withdrawing Strength and Reverse Polarity |
Open Chem. |
139���146 |
2017 |
15 |
1.425 |
|
|
47 |
S. Jamil, S. R. Khan, and M.R.S.A. Janjua* |
Synthesis and structural analysis of mesoporous magnesium hydroxide nanoparticles as efficient catalyst |
J. Chin. Chem. Soc. |
1495-1503 |
2018 |
65 |
1.188 |
|
|
48 |
W.A. Gill, M.R.S.A. Janjua* |
Ab Initio Calculations of the Interaction Potential of the N2O���N2O Dimer: Strength of the Intermolecular Interactions and Physical Insights |
J. Phys. Chem. A. |
6175-6185. |
2023 |
127 |
2.9 |
|
|
49 |
F. Bano, J. Yaqoob, R. Hussain, M. Bourass, N. Alhokbany, Z. Shafiq, M.R.S.A. Janjua*, M.U. Khan |
Doping superalkalis on chlorine substituted coronene: Interactive design computation of new NLO materials for optoelectronics |
J. Photochem. Photobiol. A. |
114810 |
2023 |
442 |
5.141 |
|
|
50 |
A. Asif, M.U. Khan, J. Yaqoob, G. Mustafa, S. Ahmed, N. Alhokbany, Z. Shafiq, M.R.S.A. Janjua |
Tuning nonlinear optical properties of tetracyclopentatetraphenylnene by superhalogens doping: Quantum chemical perspective of novel NLO materials for modern optoelectronic applications |
Mater. Sci. Eng. B. |
116763 |
2023 |
297 |
4.682 |
|
|
51 |
B. Basha, M. Sulaman, S. Elshahat, H.M. Jafri, Z.A. Alrowaili, M.S. Al-Buriahi, M.R.S.A. Janjua* |
Multidimensional modelling and designing of efficient small molecule acceptors for organic solar cells |
Mater. Sci. Eng. B. |
116618 |
2023 |
296 |
4.682 |
|
|
52 |
M.R.S.A. Janjua, Z.M. Su, W. Guan, A. Irfan, S. Muhammad, M. Iqbal |
A DFT study on the electronic and redox Properties of [X8V14O50]n??? (X ="" |
Can. J. Chem |
434-442 |
2010 |
88 |
1.374 |
|
|
53 |
M.R.S.A. Janjua*, M. Amin, M. Ali, B. Bashir, M.U. Khan, M.A. Iqbal, W. Guan, L.K. Yan, Z.M. Su |
A DFT Study on the two-dimensional (2-D) second-order nonlinear optical (NLO) response of terpyridine-substituted hexamolybdates: Physical insight of 2-D inorganic-organic hybrid functional materials |
Eur. J. Inorg. Chem. |
705-711 |
2012 |
2012 |
3.12 |
|
|
54 |
M.R.S.A. Janjua*, M.U. Khan, B. Bashir, M.A. Iqbal, Y. Song, S.A.R. Naqvi, Z.A. Khan |
Effect of ��-conjugation spacer (-C���C-) on the first hyperpolarizabilities of polymeric chain containing polyoxo-metalate cluster as a side-chain pendant: A DFT study |
Comput. Theor. Chem |
34-40 |
2012 |
994 |
1.139 |
|
|
55 |
W.A. Gill, N. Alhokbany, M.R. S.A. Janjua* |
Adsorption of molecular hydrogen on Be3Al2 (SiO3) 6-beryl: theoretical insights for catalysis, hydrogen storage, gas separation, sensing, and environmental applications |
RSC Adv. |
3782-3789 |
2024 |
14 |
3.9 |
|
|
56 |
I. Hussain, M.R.S.A. Janjua*, A.U Haq, S.U. Hassan, F.M.K. Albaqami, M.A. Alsuwat, B.M. Alrashdi, S. Alzwain, S.A.R. Naqvi |
Evaluation of Anti-Infection and Anti-Diabetic Activities in Methanolic and n-Hexane Plant Extracts of Indigenously Cultivated Chenopodium album |
Agronomy |
1340 |
2024 |
14 |
3.7 |
|
|
57 |
M. Haroon, R. Mahmood, M.R.S.A. Janjua* |
An Interesting Behavior and Nonlinear Optical (NLO) Response of Hexamolybdate Metal Cluster: Theoretical Insight into Electro-Optic Modulation of Hybrid Composites |
J. Clust. Sci. |
2693���2708 |
2017 |
28 |
1.715 |
|
|
58 |
M.R.S.A. Janjua* |
First-Principle Study on the Effect of Pi-Spacers on Small Molecule Acceptors: Quantum Design of Organic Solar Cells and NLO Compounds |
J. Clust. Sci. |
2419���2431 |
2017 |
28 |
1.715 |
|
|
59 |
M. U. Khan, M. Ibrahim, M. Khalid, M. S. Qureshi, T. Gulzar, K. M. Zia, A. A. Al-Saadi, M.R.S.A. Janjua* |
First theoretical probe for efficient enhancement of nonlinear optical properties of quinacridone based compounds through various modifications |
Chem. Phys. Lett. |
222���230 |
2019 |
715 |
2.029 |
|
|
60 |
M.R.S.A. Janjua*, Z. Shafiq, S. Shahzadi, U. Rehman, S. Shoukat, R. Azeem, S.H. Ali, L.K.M.O. Goni |
Recent Developments and Future Challenges for Perovskite Solar Cells: Physical Insights to Improve PCE |
Braz.J.Phys. |
134 |
2024 |
54 |
1.36 |
|
|
61 |
A. Rafique, F. Amjad, M.R.S.A. Janjua, S.A.R. Naqvi, S.Ul Hassan, H. Abdullah, M.S. Nazir, Z. Ali, A. A Alshihri, M.A. Momenah, A.A. Mansour, M.A Bajaber, A.A Alalwiat, |
Chia seed-mediated fabrication of ZnO/Ag/Ag2O nanocomposites: structural, antioxidant, anticancer, and wound healing studies |
Front. Chem. |
1405385 |
2024 |
12 |
3.8 |
|
|
62 |
M.R.S.A. Janjua, A. Mahmood, F. Ahmed |
Solvent effects on nonlinear optical response of certain tetrammine ruthenium(II) complexes of modi���ed 1,10-phenanthrolines |
Can. J. Chem. |
1303-1309 |
2013 |
91 |
1.013 |
|
|
63 |
M.R.S.A. Janjua* |
Non-linear Optical Response of Phenoxazine-based Dyes: Molecular Engineering of Thiadiazole Derivatives as ��-spacers |
J. Mex. Chem. Soc. |
260-265 |
2017 |
61 |
.643 |
|
|
64 |
M.R.S.A. Janjua*, W. Guan, L.K. Yan, Z.M. Su, A. Karim, J. Akbar |
Quantum chemical design for enhanced second-order NLO response of terpyridine-substituted hexamolybdates |
Eur. J. Inorg. Chem |
3466-3472 |
2010 |
2010 |
2.91 |
|
|
65 |
M.R.S.A. Janjua*, W. Guan, L.K. Yan, Z.M. Su, M. Ali, I.H. Bukhari |
Prediction of robustly large molecular second-order nonlinear optical properties of terpyridine-substituted hexamolybdates: Structural modelling towards a rational entry to NLO materials |
J. Mol. Graph. Model |
735-745 |
2010 |
28 |
2.038 |
|
|
66 |
M. Hanif, M. Rafiq, M. Saleem, M. Mustaqeem, S. Jamil, M.R.S.A. Janjua* |
Chromogenic and fluorogenic detection of copper ions in the solution and intracellular media |
J. Chin. Chem. Soc. |
500���505 |
2019 |
66 |
1.554 |
|
|
67 |
N.S. Alsaiari, M.H. Tahir, A. Hussain, N. Sultan, N. Alomayrah, MS. Al-Buriahi, M.R.S.A. Janjua* |
An innovative approach to design readily synthesizable polymers for all-polymer solar cells |
Chem. Phys. |
112379 |
2024 |
586 |
2 |
|
|
68 |
Y. Shah, M.T. Hussain, A. Mansha, M.R.S.A. Janjua* |
Impact of core modification with quinacridone derivative on the photovoltaic properties of triphenylamine-based materials: A theoretical study |
J. Photoch. Photobio. A. |
115943 |
2025 |
458 |
4.1 |
|
|
69 |
R. Mahmood, M.R.S.A. Janjua*, S. Jamil |
DFT Molecular Simulation for Design and Effect of Core Bridging Acceptors (BA) on NLO Response: First Theoretical Framework to Enhance Nonlinearity Through BA |
J. Clust. Sci. |
3175���3183 |
2017 |
28 |
1.715 |
|
|
70 |
M.R.S.A. Janjua* |
First theoretical framework of di-substituted donor moieties of triphenylamine and carbazole for NLO properties: quantum paradigms of interactive molecular computation |
Mol. Simul. |
1539���1545 |
2017 |
43 |
1.449 |
|
|
71 |
S. Jamil, S. R. Khan, B. Sultana, M. Hashmi, M. Haroon and M.R.S.A. Janjua* |
Synthesis of Saucer Shaped Manganese Oxide Nanoparticles by Co-precipitation Method and the Application as Fuel Additive |
J. Clust. Sci. |
1099���1106 |
2018 |
29 |
2.125 |
|
|
72 |
C. Lei, Z. Yang, B. Zhang, M-H Lee, Q. Jing, Z. Chen, X-C Huang, Y. Wang, S. Pan and M.R.S.A. Janjua |
The influence of hydrogen bonding on the nonlinear optical properties of a semiorganic material NH4B[D-(+)-C4H4O5]2.H2O: A theoretical perspective |
Phys. Chem. Chem. Phys. |
20089-20096 |
2014 |
16 |
4.493 |
|
|
73 |
S. Jamil, M.R.S.A. Janjua*, S.R. Khan |
Synthesis of Self-Assembled Co3O4 Nanoparticles with Porous Sea Urchin-Like Morphology and their Catalytic and Electrochemical Applications |
Aust. J. Chem, |
908-916 |
2017 |
70 |
1.059 |
|
|
74 |
Z. Shafiq, N. Akram, S. Jamil, K.M. Zia, M.R.S.A. Janjua* |
Quantum chemical modelling of non-fullerene donor and acceptor compounds for high performance organic photovoltaics and optoelectronics |
J. Solid State Chem. |
125152 |
2025 |
343 |
3.2 |
|
|
75 |
S. R. Khan, M. U. Khalid, S. Jamil, S. Li, A. Mujahid and M.R.S.A. Janjua |
Photocatalytic degradation of reactive black 5 on the surface of tin oxide microrods |
J. Water and Health, |
773-781 |
2018 |
16 |
1.683 |
|
|
76 |
M.R.S.A. Janjua* |
Structure���Property Relationship and Systematic Study of a Series of Terpyridine Based Nonlinear Optical Compounds: DFT Computation of Interactive Design |
J. Clust. Sci. |
45���51 |
2019 |
30 |
1.731 |
|
|
77 |
M. U. Khan, R. Hussain, M. Y. Mehboob, M. Khalid, M. A. Ehsan, A. Rehman, M.R.S.A. Janjua* |
First theoretical framework of Z-shaped acceptor materials with fused-chrysene core for high performance organic solar cells |
Spectrochim. Acta A Mol. Biomol. Spectrosc. |
118938 |
2021 |
245 |
4.098 |
|
|
78 |
B. Ullah, S. R. Khan*, S Ali, S. Jamil, and M.R.S.A. Janjua |
4-Nitrophenol imprinted core-shell poly (N-isopropylacrylamide-acrylic acid)/poly (acrylic acid) microgels loaded with cadmium nanoparticles: A novel catalyst |
Mater. Chem. Phys. |
124156 |
2021 |
260 |
4.094 |
|
|
79 |
M. Haroon, M. Khalid, Z. Shafiq, M.U. Khan, M.R.S.A. Janjua* |
High-throughput calculations and experimental insights towards the development of potent thiazoline based functional materials |
Mater. Today Commun. |
102485 |
2021 |
27 |
3.383 |
|
|
80 |
M.R.S.A. Janjua* |
Quantum Chemical Design of D-��-A Type Donor Materials for Highly Efficient, Photo-stable and Vacuum-processed Organic Solar Cells |
Energy Technol. |
2100489 |
2021 |
9 |
3.631 |
|
|
81 |
S. Muhammad, H.L. Xu, M.R.S.A. Janjua, Z.M. Su |
Quantum chemical study of benzimidazole derivatives to tune the second-order nonlinear optical molecular switching by proton abstraction |
Phys. Chem. Chem. Phys. |
4791-4799 |
2010 |
12 |
3.454 |
|
|
82 |
S. R. Khan, S. Jamil, S. Bibi, S. Ali, T. Habib, M.R.S.A. Janjua |
A Versatile Material: Perovskite Bismuth Ferrite Microparticles as a Potential Catalyst for Enhancing Fuel Efciency and Degradation of Various Organic Dyes |
J. Inorg. Organomet. Polym. Mater. |
3761���3770 |
2020 |
30 |
3.543 |
|
|
83 |
S. Jamil, Z. Ahmad, M. Ali, S. R. Khan, S. Ali, M. A. Hammami, M. Haroon, T. A.Saleh, M.R.S.A. Janjua* |
Synthesis and characterization of polyaniline/nickel oxide composites for fuel additive and dyes reduction |
Chem. Phys. Lett. |
138713 |
2021 |
776 |
2.328 |
|
|
84 |
S. Jamil, M.R.S.A. Janjua*, S. R. Khan, N. Jahan |
Synthesis, characterization and catalytic application of polyhedron zinc oxide microparticles |
Mater. Res. Express |
015902 |
2017 |
4 |
1.151 |
|
|
85 |
M Haroon, M.R.S.A. Janjua* |
High-Throughput Designing and Investigation of D���A��������A-Type Donor Materials for Potential Application in Greenhouse-Integrated Solar Cells |
Energy Fuels |
12461���12472 |
2021 |
35 |
3.605 |
|
|
86 |
M.R.S.A. Janjua* |
Hydrogen as an energy currency: Encapsulation of inorganic Ga12N12 with alkali metals for efficient H2 adsorption as hydrogen storage materials |
J. Phys. Chem. Solids, |
110352 |
2021 |
160 |
3.995 |
|
|
87 |
M.R.S.A. Janjua* |
Theoretical Understanding and Role of Guest ��-Bridges in Triphenylamine-Based Donor Materials for High-Performance Solar Cells |
Energy Fuels |
12451���12460 |
2021 |
35 |
3.605 |
|
|
88 |
S. R. Khan, S. Jamil, H. Rashid. S. Ali, S. A. Khan, M.R.S.A. Janjua* |
Agar and egg shell derived calcium carbonate and calcium hydroxide nanoparticles: Synthesis, characterization and applications |
Chem. Phys. Lett. |
136662 |
2019 |
732 |
2.348 |
|
|
89 |
M. Haroon, M.R.S.A. Janjua* |
Exploring the effect of end-capped modifications of carbazole-based fullerene-free acceptor molecules for high-performance indoor organic solar cell applications |
J. Comput. Electron. |
40���51 |
2022 |
21 |
1.807 |
|
|
90 |
A Irfan, M Hussien, MY Mehboob, A Ahmad, M.R.S.A. Janjua* |
Learning from fullerenes and predicting for Y6. Machine learning and high���throughput screening of small molecule donors for organic solar cells |
Energy Technol. |
101096 |
2022 |
10 |
3.631 |
|
|
91 |
S. Jamil, S.R. Khan, S. Bibi, N. Jahan, N. Mushtaq, F. Rafaqat, R.A. Khan, W.A. Gill, M.R.S.A. Janjua* |
Exploring the adsorption behavior of molecular hydrogen on CHA-zeolite by comparing the performance of various force field methods |
RSC Adv. |
30937-30950 |
2023 |
13 |
3.9 |
|
|
92 |
M.I. Abdullah, M.R.S.A. Janjua, A. Mahmood, S. Ali, M. Ali |
Quantum chemical designing of efficient sensitizers for dye sensitized solar cells |
Bull. Korean Chem. Soc |
2093-2098 |
2013 |
34 |
.913 |
|
|
93 |
M. Mutailipu, Z. Xie, X. Su, M. Zhang, Y. Wang, Z. Yang, M.R.S.A. Janjua, and S. Pan |
Chemical Cosubstitution-Oriented Design of Rare-Earth Borates as Potential Ultraviolet Nonlinear Optical Materials |
J. Am. Chem. Soc. |
18397���18405 |
2017 |
139 |
14.357 |
|
|
94 |
M.R.S.A. Janjua* |
How does bridging core modification alter the photovoltaic characteristics of triphenylamine���based hole transport materials? Theoretical understanding and prediction |
Chem. Eur. J. |
4197-4210 |
2021 |
27 |
5.236 |
|
|
95 |
M. Y. Mehboob, R. Hussain, S. Jamil, M. Ahmed, M. U. Khan, M. Haroon, M.R.S.A. Janjua* |
Physical-Organic Aspects along with Linear and Nonlinear Optical Properties of Benzene Sulfonamide Compounds: In Silico Analysis |
J. Phys. Org. Chem. |
e4313 |
2022 |
35 |
2.391 |
|
|
96 |
M.R.S.A. Janjua |
Impact of symmetry breaking on the performance of non-fullerene acceptors (NFAs) for photo and thermally stable organic solar cells (OSCs): a DFT-based interrogation and investigation |
J. Photochem. Photobiol. A |
115003 |
2023 |
444 |
5.141 |
|
|
97 |
M.U. Khan, S. Nadeem, A. Fatima, J. Yaqoob, M. Khalid, F. Abbas, N. Alhokbany, M.R.S.A. Janjua* |
DFT molecular simulations for static, dynamic and solvent-dependent nonlinear optical properties of triphenylamine-carbazole-based organic dyes with DDA framework |
J. Mol. Liq. |
123258 |
2023 |
391 |
6.27 |
|
|
98 |
S. Jamil, H. Ahmad, S. R. Khan, M.R.S.A. Janjua* |
The first morphologically controlled synthesis of a nanocomposite of graphene oxide with cobalt tin oxide nanoparticles, |
RSC Adv. |
36647���36661 |
2018 |
8 |
3.168 |
|
|
99 |
S. Jamil, S. R. Khan, A. R. Alvi, F. Kausar, S. Ali, S.A.Khan, M. Naim, A. Malik, M.R.S.A. Janjua* |
Morphologically Controlled Synthesis, Characterization and Application of Zinc-Aluminum Layered Double Hydroxide Nano Needles |
Chem. Phys. |
110530 |
2020 |
528 |
2.348 |
|
|
100 |
Q. UlAin, S. Ali, S. Jamil, S. Bibi, S.R. Khan, S. UrRehman, G. Bibi, T. Khan, H. Shehroz, M. Hashaam, M.R.S.A. Janjua |
Comparison of catalytic and fuel additive properties of bimetallic nanoparticles and its composite: FeMnO3 and PANI-FeMnO3 |
Mater. Sci. Semicond. Process, |
106630 |
2022 |
144 |
3.927 |
|
|
101 |
M Haroon, M.R.S.A. Janjua* |
Computationally Assisted Design and Prediction of Remarkably Boosted NLO Response of Organoimido���Substituted Hexamolybdates |
J. Phys. Org. Chem. |
e4353 |
2022 |
35 |
2.391 |
|
|
102 |
M.R.S.A. Janjua* |
Quantum chemical design and prediction that complements understanding: How do the transition metals enhance the CO2 sensing ability of inorganic Mg12O12 nanoclusters? |
J. Phys. Chem. Solids |
110789 |
2022 |
167 |
4.383 |
|
|
103 |
M.R.S.A. Janjua* |
Quantum chemical designing of triphenylamine dyes with da-��-�� configuration for dye sensitized solar cells: Molecular engineering through first-principles calculations, |
J. Chil. Chem. Soc. |
3850���3854. |
2018 |
63 |
.6 |
|
|
104 |
S. Jamil*, F. Farooq , S. R. Khan, and M.R.S.A. Janjua* |
Synthesis of WSe2 Nano-rods by Selenium Powder Precursor for Photocatalytic Application and Fuel Additive |
J Clust. Sc. |
1061���1073 |
2020 |
32 |
3.061 |
|
|
105 |
M.R.S.A. Janjua* |
All-small-molecule organic solar cells with high fill factor and enhanced open-circuit voltage with 18.25 % PCE: Physical insights from quantum chemical calculations |
Spectrochim. Acta A Mol. Biomol. Spectrosc. |
121487 |
2022 |
279 |
4.831 |
|
|
106 |
M.U. Khan, F. Shafiq, M.R.S.A. Janjua*, M. Khalid, J. Yaqoob, M. Arshad, S.M. Alshehri, R.A. Khan |
Predicting benzodithiophene based donor materials with enhanced 19.09% PCE, open-circuit voltage and optoelectronic attributes for solar cell applications: Photochemical insights from DFT |
J. Photochem. Photobiol. A. |
115115 |
2024 |
446 |
5.141 |
|
|
107 |
W.A. Gill, M.T. Aziz, H.W. Darwish, M.R.S.A. Janjua* |
Exploring HCl���HCl interactions: QZVPP calculations, improved Lennard-Jones potential, and second virial coefficient analysis for thermodynamics and industrial applications |
RSC Adv. |
1890-1901 |
2024 |
14 |
3.9 |
|
|
108 |
S. R. Khan, S. Kanwal, M. Hashaam, S. Jamil, B. Ullah, and M.R.S.A. Janjua |
Investigation of Catalytic and Fuel Additive Applications of Copper/Copper(I) Oxide/Copper(II) Oxide (Cu/CuO/Cu2O) Microspheres Synthesized by Hydrothermal Method using Sucrose as Template |
Mater. Res. Express |
025036 |
2020 |
7 |
1.62 |
|
|
109 |
R. Ashraf, M. A. Iqbal, H. N. Bhatti, M.R.S.A. Janjua, M. El???Naggar |
Bioactivity and DNA/BSA Interactions of Selenium N???Heterocyclic Carbene Adducts |
Chemistry Select. |
10970-10981 |
2020 |
5 |
2.109 |
|
|
110 |
S. Naz, G. Bibi, S. Jamil, S. UrRehman, S. Bibi, S. Ali, T. Khan, S.R. Khan, M.R.S.A. Janjua |
Preparation of manganese-doped tin oxide nanoparticles for catalytic reduction of organic dyes |
Chem. Phys. Lett. |
139768 |
2022 |
802 |
2.719 |
|
|
111 |
A. Umar, J. Yaqoob, M.U. Khan, R. Hussain, A.A. Abdulraheem. S.A. Almalki, M.R.S.A. Janjua* |
Doping of superalkali and superhalogen on graphene quantum dot surfaces to enhance nonlinear optical response: An efficient strategy for fabricating novel electro-optical materials |
J. Phys. Chem. Solids |
110859 |
2022 |
169 |
4.383 |
|
|
112 |
M.A. Afzal, M.U. Khan, M.U. Alvi, J. Yaqoob, N. Alhokbany, S. Ahmed, M.R.S.A. Janjua* |
Exploring novel naphthalene-fused octacyclic core-based non-fullerene acceptor materials with augmented optoelectronic attributes for stable and efficient solar cells |
J. Mol. Struct. |
136646. |
2024 |
1295 |
3.841 |
|
|
113 |
M.U. Khan, S. Nadeem, A. Fatima, J. Yaqoob, F. Abbas, H.W. Darwish, M.R.S.A. Janjua* |
Theoretical study of static and frequency-dependent nonlinear optical properties of 1-phenyl-2, 5-di (thiophen-2-yl)-1H-pyrrole based D-��-A chromophores through ��-linkers modifications: A gateway towards giant nonlinear optical compounds |
Mater. Sci. Eng. B. |
116993 |
2024 |
299 |
4.682 |
|
|
114 |
T. Mubashir, M.H. Tahir, Z. Shafiq, A.Z. Dewidar, H.O. El-ansary, M.R.S.A. Janjua* |
An efficient framework to design near-IR monomers for polymer solar cells with the help of machine learning, virtual screening and chemical space visualization |
J. Photochem. Photobiol. A. |
115285 |
2024 |
447 |
5.141 |
|
|
115 |
A. Mahmood, S. Naeem, A. Javed, Z. Shafiq, M.A. El-Sheikh, H.O. Elansary, M.R.S.A. Janjua* |
A. Mahmood, S. Naeem, A. Javed, Z. Shafiq, M.A. El-Sheikh, H.O. Elansary, M.R.S.A. Janjua*, Chemical similarity-based design of materials for organic solar cells: Visualizing the generated chemical space of polymers |
Mater. Today Commun. |
108403 |
2024 |
38 |
4.06 |
|
|
116 |
M.Y. Mehboob, R. Hussain, M.U. Khan, M. Adnan, M. A. Ehsan, A. Rehman, M.R.S.A. Janjua* |
Quantum chemical design of near���infrared sensitive fused ring electron acceptors containing selenophene as �����bridge for high���performance organic solar cells |
J. Phys. Org. Chem. |
e4204 |
2021 |
34 |
2.391 |
|
|
117 |
O.A.A. Ali, M.U. Khan, M.A. Asghar, S.F. Mahmoud, S.M. El-Bahy, R. Baby, M.R.S.A. Janjua* |
A new cyano (���C ��� N) free molecular design perspective for constructing carbazole-thiophene based environmental friendly organic solar cells |
Phys. B: Condens. Matter. |
414630. |
2023 |
652 |
2.988 |
|
|
118 |
T. Hassan, I. Sajid*, M.R.S.A. Janjua*, Z. Shafiq*, M.Y. Mehboob, N. Sultan* |
Non-fullerene based photovoltaic materials for solar cell applications: DFT-based Analysis and Interpretation |
Comput. Theor. Chem. |
114128 |
2023 |
1224 |
6.578 |
|
|
119 |
M.R.S.A. Janjua*, S. Jamil, A. Mahmood, A. Zafar, M. Haroon and H. N. Bhatti |
Solvent-Dependent Non-Linear Optical Properties of 5, 5���-disubstituted-2, 2���-bipyridine Complexes of Ruthenium (II): A Quantum Chemical Perspective |
Aust. J. Chem. |
1502-1507 |
2015 |
68 |
1.427 |
|
|
120 |
S.A.R. Naqvi, A.J. Hassan, M.R.S.A. Janjua*, N. Abbas, A.F. Zahoor, S.U. Hassan, A. Hussain |
Radiolabeling and preclinical animal model evaluation of DTPA coupled 99mTc-labelled flutamide complex ([99mTc] DTPA-FLUT) as a potential radiotracer for cancer imaging |
Acta Radiologica |
02841851241249161 |
2024 |
65 |
1.701 |
|
|
121 |
M.H. Tahir, N. Sultan, Z. Shafiq, I.M. Moussa, S. Sridhara, M.R.S.A. Janjua* |
Design of organic electronic materials with lower exciton binding energy: machine learning analysis and high-throughput screening |
Opt. Quant. Electron. |
1324 |
2024 |
56 |
3.3 |
|
|
122 |
M.R.S.A. Janjua*, M. Haroon, R. Hussain, M. Usman, M.U. Khan, and W. A. Gill |
Computational Engineering to Enhance the Photovoltaic (PV) by End-Capped and Bridging Core Alterations: Empowering the Future with Solar Energy through Synergistic Effect in D-A Materials |
Int. J. Quantum Chem. |
e26821 |
2021 |
122 |
2.444 |
|
|
123 |
G Bibi, SR Khan, S Ali, S Jamil, S Bibi, H Shehroz, M.R.S.A. Janjua |
Role of capping agent in the synthesis of zinc-cobalt bimetallic nanoparticles and its application as catalyst and fuel additive |
Appl. Nanosci, |
2169-2181 |
2022 |
12 |
3.869 |
|
|
124 |
W.A. Gill, M.R.S.A. Janjua* |
Exploring the Adsorption Mechanism of N2O on Graphene: A DFT Study on Circum-Coronene for Catalysis, Sensing, and Energy Storage Applications |
J. Phys. Chem. A. |
5591���560 |
2023 |
127 |
2.9 |
|
|
125 |
Z. Shafiq, S.A.R. Naqvi, M.R.S.A. Janjua, S. Jamil |
First Theoretical Engineering of Robust C-C Single bond-based Acceptor Materials for Efficient Organic Photovoltaics |
J. Photochem. Photobiol. A |
114782 |
2023 |
442 |
5.141 |
|
|
126 |
S. Jamil, S.R. Khan, S. Ali, S. Bibi, R.A. Khan, W.A. Gill, M.R.S.A. Janjua* |
Synthesis of calcium-bismuth layered double hydroxide (LADH) Nanoparticles: Applications as Photo-catalyst and Fuel Additive |
Inorg. Chem. Commun. |
1111331 |
2023 |
157 |
3.8 |
|
|
127 |
S. Jamil, H. Ahmed, S. R. Khan, and M.R.S.A. Janjua* |
First Synthetic Study of Cube-Like Cobalt Hydroxystannate Nanoparticles as Photocatalyst for Drimarene Red K-4BL Degradation and Fuel Additive |
J. Clust. Sci. |
685-696 |
2018 |
29 |
2.125 |
|
|
128 |
M.R.S.A. Janjua* |
Structural Properties and Nonlinear Optical Responses of Halogenated Compounds: A DFT Investigation on Molecular Modelling |
Open Chem |
978���985 |
2018 |
16 |
1.599 |
|
|
129 |
M.R.S.A. Janjua* |
Synthesis of Co3O4 Nano Aggregates by Co-precipitation Method and its Catalytic and Fuel Additive Applications |
Open Chem. |
865���873 |
2019 |
17 |
1.216 |
|
|
130 |
S. Waheed, M.U. Khan, A. Anwar, G. Mustafa, A.U. Hassan, T. Ahamad, M.R.S.A. Janjua* |
DFT molecular simulations for designing anthradithiophene-based photo and thermally stable solar cell compounds with enhanced fill factor, open-circuit voltage, and optoelectronic properties |
Comput. Theor.Chem. |
114771 |
2024 |
1239 |
3 |
|
|
131 |
A. Fatima, M.U. Khan, J. Yaqoob, G. Mustafa, A.U. Hassan, M.R.S.A. Janjua, A. Sohail, R. Alotaibi |
Designing Novel Photosensitizers Based on Pyridoquinazolinone and Its TiO2-Adsorbed Complexes with Efficient Photovoltaic Performance in DSSCs: A DFT Insight |
J. Electron. Mater. |
1-25 |
2024 |
54 |
2.2 |
|
|
132 |
M.R.S.A. Janjua, C.G. Liu, W. Guan, S. Muhammad, L.K. Yan, Z.M. Su |
Prediction of remarkably large second-order nonlinear optical properties of organoimido-substituted hexamolybdates |
J. Phys. Chem. A, |
3576-3587 |
2009 |
113 |
2.899 |
|
|
133 |
M.A.Z.G. Sial, M. Mateen, R. Naz, M. Abbas, N. Abbas, S.H. Talib, M.R.S.A. Janjua*, M. Qamar |
Alloying platinum single atoms with nickel iron nanoalloys for high performance hydrogen evolution reaction |
Int. J. Hydrog. Energy. |
540-549 |
2024 |
31 |
7.67 |
|
|
134 |
M.T. Aziz, W.A. Gill, M.K. Khosa, S. Jamil, M.R. S.A. Janjua* |
Adsorption of molecular hydrogen (H 2) on a fullerene (C 60) surface: insights from density functional theory and molecular dynamics simulation |
RSC Adv. |
36546-36556 |
2024 |
14 |
3.9 |
|
|
135 |
S. Shahzadi, M. Akhtar, M. Arshad, M.H. Ijaz, M.R. S.A. Janjua* |
A review on synthesis of MOF-derived carbon composites: innovations in electrochemical, environmental and electrocatalytic technologies |
RSC Adv. |
27575-27607 |
2024 |
14 |
3.9 |
|
|
136 |
S. R. Khan, M. Batool, S. Jamil, S. Bibi, S. Abid, M.R.S.A. Janjua |
Synthesis and Characterization of Mg���Zn Bimetallic Nanoparticles: Selective Hydrogenation of p Nitrophenol, Degradation of Reactive Carbon Black 5 and Fuel Additive |
J. Inorg. Organomet. Polym. Mater. |
438���450. |
2020 |
30 |
3.543 |
|
|
137 |
S. R. Khan*, A. Naeem, S. Jamil, A. I. Aqib, M.R.S.A. Janjua |
Synthesis of manganese���tin oxide microparticles by the solvothermal method and study of application as a catalyst and additive |
Environ. Technol. |
1187-1195 |
2021 |
42 |
3.247 |
|
|
138 |
Y. Shah, M.T. Hussain, A. Mansha, M.R.S.A. Janjua* |
Exploring the potential of quinacridone-porphyrin-based materials for nitrogen oxides sensing: quantum chemical design, mechanism and future prospects, |
Adsorption |
2053-2067 |
2024 |
30 |
3.32 |
|
|
139 |
Z. Shafiq, N. Akram, K.M. Zia, S. Jamil, S. Li, N. Alhokbany, M.R.S.A. Janjua* |
Unveiling next-generation organic photovoltaics: Quantum mechanical insights into non-fullerene donor���acceptor compounds |
Spectrochim Acta A. |
125741 |
2025 |
330 |
4.3 |
|
|
140 |
S. Jamil, M.R.S.A. Janjua*, T. Ahmad, T. Mehmood, S. li, X. Jing |
Zinc oxide hollow micro spheres and nano rods: Synthesis and applications in gas sensor |
Mater. Chem. Phys. |
225-231 |
2014 |
147 |
2.259 |
|
|
141 |
S. Shahzadi, T. Shahzadi, Z. Shafiq, M.R.S.A. Janjua* |
A Review on Fabrication and Quantum Chemical Designing of Organic Solar Cells: Role of DFT and Machine Learning Technologies |
High Energ. Chem. |
583-603 |
2024 |
58 |
.96 |
|
|
142 |
Y. Song, M. R. S. A. Janjua*, S. Jamil, M. Haroon, S. Nasir, Z. Nisar, A. Zafar, N. Nawaz, A. Batool, A. Aziz |
The NLO properties of hybrid materials based on molybdate/hexamolybdate derivatives: A theoretical perspective for electro-optic modulation |
Synth. Met |
277-284 |
2014 |
198 |
2.252 |
|
|
143 |
S. Ali, S.J.H. Shah, S. Jamil, S. Bibi, M.U. Shah, A.I. Aqib, T. Zaheer, S.R. Khan, M.R.S.A. Janjua |
Zirconium Nanoparticles-Poly (N-isopropylacrylamide-methacrylic acid) Hybrid Microgels Decorated Graphene Sheets for Catalytic Reduction of Organic Pollutants |
Chem. Phys. Lett. |
138915 |
2021 |
780 |
2.328 |
|
|
144 |
M.R.S.A. Janjua*, Z. H. Yamani, S. Jamil, A. Mahmood, I. Ahmad, M. Haroon, M. H. Tahir, Z. Yang, S. Pan |
First principle study of electronic and non-linear optical (NLO) properties of triphenylamine dyes: Interactive design computation of new NLO compounds |
Aust. J. Chem. |
467-472 |
2016 |
69 |
1.267 |
|
|
145 |
S. Muhammad, M.R.S.A. Janjua, Z.M. Su |
Investigation of dibenzoboroles having ��-electrons: Toward a new type of two-dimensional NLO molecular switch? |
J. Phys. Chem. C |
12551-12557 |
2009 |
113 |
4.224 |
|
|
146 |
S. R. Khan, S. Jamil, M.R.S.A. Janjua*, R. A. Khera |
Synthesis of ferric oxyhydroxide nanoparticles and ferric oxide nanorods by reflux assisted coprecipitation method and comparative study of their thermal properties |
Mater. Res. Express. |
115019 |
2017 |
4 |
1.151 |
|
|
147 |
S. R. Khan, S. Jamil, and M.R.S.A. Janjua* |
Radiation assisted synthesis of dumb bell shaped calcium hydroxide nanostructures from egg shells and study of its thermal and catalytic applications |
Chem. Phys. Lett |
45���53 |
2018 |
710 |
1.696 |
|
|
148 |
N. F. Zubair, S. Jamil, S. Fatima, S.R. Khan, M.U. Khan, M.R.S.A. Janjua* |
Synthesis of Needle like Nano Composite of rGO-Mn2O and their Applications as Photo-catalyst |
Chem. Phys. Lett. |
137874 |
2020 |
757 |
2.328 |
|
|
149 |
S. Jamil, A. R. Alvi, S. R. Khan, M.R.S.A. Janjua* |
Layered Double Hydroxides (LDHs): Synthesis & Applications |
Prog. Chem |
394���412 |
2019 |
31 |
1.013 |
|
|
150 |
S. R. Khan, S. Jamil, S. Ali, S.A. Khan, M. Mustaqeem, M.R.S.A. Janjua* |
Synthesis and Structure of Calcium-tin Hybrid Microparticles from Egg Shell and Investigation of their Thermal Behavior and Catalytic Application |
Chem. Phys. |
110613 |
2020 |
530 |
2.348 |
|
|
151 |
A Mahmood, A Irfan, F Ahmad, M.R.S.A. Janjua |
Quantum chemical analysis and molecular dynamics simulations to study the impact of electron-deficient substituents on electronic behavior of small molecule acceptors |
Comput. Theor. Chem, |
113387 |
2021 |
1204 |
1.926 |
|
|
152 |
M. U. Khan, R. Hussain, M. Y. Mehboob, M. Khalid, Z. Shafiq, M. Aslam, A. A. Al-Saadi, S. Jamil, M.R.S.A. Janjua* |
In Silico Modeling of New ���Y-Series���-Based Near-Infrared Sensitive Non-Fullerene Acceptors for Efficient Organic Solar Cells |
ACS Omega |
24125���24137 |
2020 |
37 |
3.512 |
|
|
153 |
S. R. Khan, S. Ali, G. Zahra, S. Jamil*, M.R.S.A. Janjua* |
Synthesis of monetite micro particles from egg shell waste and study of its environmental applications: Fuel additive and catalyst |
Chem. Phys. Lett. |
137804 |
2020 |
755 |
2.328 |
|
|
154 |
M. Y. Mehboob, R. Hussain, M. Adnan, Saira, U. Farwa, Z. Irshad, M.R.S.A. Janjua* |
Theoretical modelling of novel indandione-based donor molecules for organic solar cell applications |
J. Phys. Chem. Solids |
110508 |
2022 |
162 |
2.391 |
|
|
155 |
M.R.S.A. Janjua* |
Density Functional Theory Predictions of the Nonlinear Optical (NLO) Properties in Triphenylamine based ��-Cyanocinnamic Acid Compounds: Effect of Fluorine on NLO Response |
J. Mex. Chem. Soc. |
125-134. |
2018 |
62 |
.973 |
|
|
156 |
M.U. Khan, M. Khalid, M. Ibrahim, A.A.C. Braga, M. Safdar, A. A. Al-Saadi, M.R.S.A. Janjua* |
First Theoretical Framework of Triphenylamine???Dicyanovinylene-Based Nonlinear Optical Dyes: Structural Modification of ?????Linkers. |
J. Phys. Chem. C |
4009-4018 |
2018 |
122 |
4.309 |
|
|
157 |
M.R.S.A. Janjua*, A. Mahmood, M. F. Nazar, Z.H. Yang, and S.L. Pan |
Electronic Absorption Spectra and Nonlinear Optical Properties of Ruthenium Acetylide Complexes: A DFT Study toward the Designing of New High NLO Response Compounds |
Acta Chim. Sol. |
382-390 |
2014 |
61 |
.686 |
|
|
158 |
M.R.S.A. Janjua*, S. Jamil, T. Ahmad, Z. Yang, A. Mahmood, S. Pan |
Quantum Chemical Perspective of Efficient NLO Materials Based on Dipolar Trans-tetraammineruthenium (II) Complexes with Pyridinium and Thiocyanate Ligands: First Theoretical Framework |
Comp. Theor. Chem |
6-13 |
2014 |
1033 |
1.545 |
|
|
159 |
S.J.U.H. Shah, S. Jamil, S. Ali, S.R. Khan, M.R.S.A. Janjua |
Synthesis of Rod Like Chromium/Manganese Layer Double Hydroxide and Applications |
Russ. J. Phys. Chem. A. |
1215���1227 |
2022 |
96 |
.791 |
|
|
160 |
Z. A. Khan*, S. A. R. Naqvi, A. Mukhtar, Z. Hussain, S. A. Shahzad, A. Mansha, M. Ahmad, A. F. Zahoor, I. H. Bukhari, M.R.S.A. Janjua, N. Mahmood and M. Yar |
Antioxidant and antibacterial activities of Hibiscus Rosa-sinensis Linn flower extracts |
Pak. J. Pharm. Sci |
469-474 |
2014 |
27 |
.682 |
|
|
161 |
M.F. Nazar, A. Badshah, A. Mahmood, M.N. Zafar, M.R.S.A. Janjua, M.A. Raza and R. Hussain |
Synthesis, spectroscopic characterization, and computed optical analysis of green fluorescent cyclohexanone derivatives |
J. Phys. Org. Chem. |
152-160 |
2016 |
29 |
1.336 |
|
|
162 |
S. Jamil, M.R.S.A. Janjua*, T. Ahmad |
The synthesis of flower shaped microstructures of Co3O4 by solvothermal approach and investigation of its catalytic activity |
Solid State Sci. |
73-79 |
2014 |
36 |
1.839 |
|
|
163 |
S. Jamil, M.R.S.A. Janjua*, S. R. Khan |
Synthesis and structural investigation of polyhedron Co3O4 nanoparticles: Catalytic application and as fuel additive |
Mater. Chem. Phys. |
82���92 |
2018 |
216 |
2.461 |
|
|