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Chemical Physics Impact
Number of Followers: 1  Subscription journalISSN (Print) 2667-0224 Published by Elsevier  [2974 journals]
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- Design of magnetic organic molecules and organic magnets: Experiment,
theory and computation with application and recent advances-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): Sambhu N. Datta, Arun K. Pal, Anirban Panda
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- Identification of interaction of
1,2,3,6-Tetrahydro-2,6-dioxo-4-pyrimidinecarboxylic acid using DFT
studies, molecular docking, biological activity and topology analysis for
biological applications-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): M. Amalanathan, T. Brintha, S. Sijana, P.J. Jegan Babu, M. Sony Michael Mary
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- Mononuclear ZnII complex of a hexadentateiminophenolate-based O,O,N,N,O,O
ligand: Experimental and theoretical vision-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): Manoj Kumar, Seraj Ahmad, Kahkashan Khatoon, Saleem Javed, Ravindra Singh, Ramesh Chandra, Himanshu Arora, Akram Ali
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- An investigation of the antimicrobial and antioxidant efficacy of copper
oxide (I) nanoparticles: A green approach from Myrica esculenta fruit
extract-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): Ankush Chauhan, Jyoti Dhatwalia, Neetika, Vishal Dutta, Chandrasekaran Gopalakrishnan, Garima Rana, Gnanadhas Sobhin Hikku, Amita Kumari, Rohit Duglet, Suresh Ghotekar
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- Oxidative functionalization of triterpenes isolated from Euphorbia
resinifera latex: Semisynthesis, ADME-Tox, molecular docking, and
molecular dynamics simulations-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): Imane Yamari, Ayoub Mouhib, Bouchra Es-Sounni, Rida Nejjari, Noureddine Mazoir, Mohamed Bakhouch, Abdelkrim Mouzdahir, Ahmed Benharref, M'hammed El Kouali, Samir Chtita
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- Spectroscopic (FTIR, FT-Raman, UV–Vis) studies, NMR, NBO analysis,
molecular docking studies on 2-cyano-5-fluoropyridine and
3-cyano-2-fluoropyridine-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): R. Vinodkumar, T. Jayavarthanan, S. Suresh, S. Periandy, V.S.K. Venkatachalapathy
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- Energy storage, sensors, photocatalytic applications of green synthesized
ZnO: Fe3+ nanomaterials-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): Ramachandra Naik, A Naveen Kumar, Vijaya Shanbhag, H.P. Nagaswarupa, Rajender Boddula, Abdullah A. Al-Kahtani, Kulurumotlakatla Dasha Kumar
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- In silico study of traditional Chinese medicinal compounds targeting
alzheimer's disease amyloid beta-peptide (1–42)-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): V. Naveen Kumar, T. Tamilanban, T. Safiya Sultana, K. Manasa, E. Ragulkumar, J. Vinoth Kumar, Mir Waqas Alam, K. Arul
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- Repurposing of monacolin K decorated BN nanoparticle on inhibition of
HMG-CoA reductase: In silico approach-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): Vahid Khori, Mahdi Zahedi, Hassan Mirzaei, Ali Jabbari, seyedbabak Mojaveraghili, Seyed Ghadir Hosseini
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- Improved acrylonitrile-butadiene-styrene surface properties via
electroless (NiP-SiC) nanocomposite coating-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): Rusul Khalid Alhamad, Abbas Khammas Hussein, Laith Kais Abbas
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- Biocompatibility of ionic liquid tagged terpyridine complexes with potent
biological activity-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): M. Antilin Princela, B.T. Delma, S. Lizy Roselet, M. Shirly Treasa, M. Jaya Brabha, C. Isac Sobana Raj
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- Understanding the binding interaction mechanism of i-motif with
fluorophores: A biophysical approach-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): Hibbana Fathima Mohamed Ibrahim, Rupavarshini Manoharan, Bernet Shano Leon, Navaneeth Alanthata Govindan, Karthikeyan Subramani
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- Design of a new potent Alzheimer's disease inhibitor based on QSAR,
molecular docking and molecular dynamics investigations-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): Meriem Khedraoui, Hassan Nour, Imane Yamari, Oussama Abchir, Abdelkbir Errougui, Samir Chtita
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- DFT study of bismuth subsalicylate adsorption on bow-tie dendrimer
nanocarrier as drug delivery agents-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): Vinicius Souza Macedo, Karinna Gomes Oliveira Rodrigues, Nicolas Nascimento Ciribelli, Anna Karla dos Santos Pereira, Grasiele Soares Cavallini, Douglas Henrique Pereira
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- Stirring effect of CuS deposition over cotton thread for photocatalysis
and electrical application-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): Khushboo, Himanshu Sharma, Manohar Singh, Munish Kumar Yadav, Surbhi
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- Fluorescence based studies on the interaction and characterization of
surface-active ionic liquids with polarity sensitive intramolecular charge
transfer probe-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): Dhiman Ray, Dipak Chamlagai, Sugam Kumar, Vinod K. Aswal, Sivaprasad Mitra
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- Photodegradation of Methyl violet using Ag modified TiO2 nanotubes by UV
and UV/ H2O2-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): Ashega Sherly R, C M Padma, D Henry Raja, D Jonas Davidson
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- Exploring linear and nonlinear optical behaviour of morpholine
p-nitrophenol crystal: Computational and experimental analysis-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): R. Sivaranjani, A. Suvitha, Medhansh Garg, T. Arumanayagam
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- Experimentally-measured rate parameters for vibrational quenching of CO by
N2-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): Justin Z. Bye, Adam M. Baranik, Madeline V. Hinkle, Anthony J. Gesford, Jordan M. Polvere, Aleksandr Davtyan, Karen J. Castle
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- Assessments of carbon and boron nitride graphdiyne nanosheets for
exploring the amphetamine drug adsorbents/sensors along with density
functional theory-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): M.J. Saadh, S.M. Mohealdeen, C.Y. Hsu, U.A. Jumanazarov, R.R. Maaliw, M. Mirzaei, M. Da'i, K. Harismah
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- Synthesis, dielectric and impedance spectroscopy study of temperature
stable Ta2O5 modified 0.85BaTiO3-0.15Bi(Mg0.5Ti0.5)O3 ceramics-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): Abdul Manan, Gul Shah Jahan, Maqbool Ur Rehman, Michael T. Lanagan
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- Molecular structural analysis, conformers and spectral (FT-IR, FT-Raman,
NMR and UV-Visible), Importance of solvent role in molecular, ADME and
molecular docking investigation on alpha-cyano-4-hydroxycinnamic acid-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): P. Aiswarya, T. Jayavarthanan, S. Periandy, S. Suresh, S. Soundhariya
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- Green synthesis of copper oxide nanoparticles using Amaranthus dubius leaf
extract for sensor and photocatalytic applications-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): P. Mohammed Yusuf Ansari, R.M. Muthukrishnan, R. Imran Khan, C. Vedhi, K. Sakthipandi, S.M. Abdul Kader
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- Computational assessments of sumanene-hydroxyurea conjugations for
proposing a novel drug design and delivery platform-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): M.J. Saadh, M. Mirzaei, H.H. Ahmed, W.M. Taher, M. Alwan, H. Meliyev, R.R. Maaliw III, M. Da'i
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- Tuning the thermoelectric properties of graphene nanoribbons by vacancy
defect with Ge-doping-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): Fouad N. Ajeel, Ali Ben Ahmed
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- Effect of AlN dimers on the electronic properties of graphene quantum dot:
DFT investigations-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): Fouad N. Ajeel, Salam K. Khamees, Kareem H. Mohsin, Mohammed N. Mutier
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- Complex dielectric response and EDL characteristics of different types of
ionic liquid iron oxide nanofluids (ionanofluids)-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): Aswathy Joseph, Jacek Fal, Andrzej Ba̧k, Suresh Mathew, Gaweł Żyła
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- Fluorescence correlation spectroscopy measurements on amyloid fibril
reveal at least two binding modes for fluorescent sensors-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): Aranyak Sarkar, Vinu Namboodiri, Manoj Kumbhakar
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- An in-depth exploration of eco-friendly synthesis methods for metal oxide
nanoparticles and their role in photocatalysis for industrial dye
degradation-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): D.M. Tejashwini, H.V. Harini, H.P. Nagaswarupa, Ramachandra Naik, V.V. Deshmukh, N. Basavaraju
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- Schmidt number's impact during the growth of mc-silicon ingot through
directional solidification furnace for photovoltaic applications: A
computational investigation-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): T. Keerthivasan, M. Srinivasan, R. Madhesh, P. Ramasamy
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- Electrical conduction mechanism in multiferroic Gd doped GaFeO3
-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): Khusboo Agrawal, Banarji Behera, S.C. Sahoo, S.K. Rout, Ashok Kumar, Dhiren K. Pradhan, Piyush R. Das
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- Fast microwave synthesis and white luminescent emission from
Pb1–2xCaxSrxMoO4 (x=0; 0.3; and 0.5) particles-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): C.R.D. Ferreira, A.A.G. Santiago, M.Siu Li, R.L. Tranquilin, F.V. Motta, M.R.D. Bomio
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- Synthesis, crystal structure, DFT, Hirshfeld surface, 3D energy frameworks
analysis and molecular docking of pyrimidine derivative: A theoretical and
experimental approach-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): Aysha Fatima, Ghazala Khanum, Nazia Siddiqui, S. Muthu, Mohd Afzal, R.J. Butcher, Sanjay Kumar Srivastava, Saleem Javed
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- Phosphorus encapsulated gallium nitride and aluminum nitride nanotubes as
nonenzymatic sensors for fructose, glucose, and xylose sugars as
biomarkers for diabetes-mellitus: Outlook from computational study-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): Anna Imojara, Joyce E. Ishegbe, Hewa Abdullah, Henry O. Edet, Terkumbur E. Gber, Maxwell-Borjor A. Eba, Anthony M.S. Pembere, Hitler Louis
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- The impact of lead on structural, electronic, and vibrational properties
of pristine C36 and its boron, nitrogen-dopant C36 on pentagonal and
hexagonal rings-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): Shaida Anwer Kakil, Hewa Y. Abdullah, Tahseen G. Abdullah
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- Theoretical modelling of the structure, reactivity, and the application of
Co (II), Cu (II), and Ni (II) Schiff base complexes as sensor materials
for phosgene (COCl2) gas-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): Celine Ngwang, Felicite Majoumo-Mbe, Emmanuel N. Nfor, Mirabel Akongwi, Henry O. Edet, Edward A. Afu, Terkumbur E. Gber, Rawlings A. Timothy, Nwokolo A. Obianuju, Adedapo S. Adeyinka, Offiong E. Offiong, Hitler Louis
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- Density functional theory and molecular docking studies on electronic and
optical features of poly (lactic acid) interacting with celecoxib-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): Marzie Saghali, E. Tazikeh Lemeski, Mozhgan Fekri Baraghoosh, Hassan Mirzaei, Seyed Reza Khandoozi, Vahid Erfani-Moghadam, Shohreh Taziki, Alireza Soltani
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- Chemical modifications of boron nitride nanotubes with heterocyclic
molecules: A DFT study-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): Abdelmajeed Adam Lagum, Wathiq Kh. Mohammed, Eyhab Ali, Sahar balkit hussein, Usama S. Altimari, Ashwaq Talib Kareem, Ali Alsalamy, Ameer S. Alkhayyat, Hashem Al-Shaaban
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- Tweaking and collating the structural, optical and magnetic properties of
auto combusted lanthanum ferrites - study on effect of precursor
concentration-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): S Adline Benila, V Anslin Ferby
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- Enhancement the electronic and optical properties of the T- graphene
nanosheet in the present various impurities: DFT study-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): Tuqa A. Omeer, Mohammed H. Mohammed, Basim Abdulhussein Jarullah, Safaa Halool Mohammed
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- Unraveling the impact of polar solvation on the molecular geometry,
spectroscopy (FT-IR, UV, NMR), reactivity (ELF, NBO, HOMO-LUMO) and
antiviral inhibitory potential of Cissampeline by molecular docking
approach-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): Michael O. Odey, Ekpo E. Antai, Eze A. Adindu, Obinna C. Godfrey, Ini U. Bassey, Fransica O. Nwaokolrie, Ayodeji Owolabi, Ani Nkang, Terkumbur E. Gber, Moses M. Edim, Hitler Louis
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- Physical, chemical, electronic and optical properties of CuO/NiO@n-Si thin
films by drop casting method for p–n junction diode-
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Abstract: Publication date: Available online 21 October 2023Source: Chemical Physics ImpactAuthor(s): Elumalai Arulkumar, Sethuramachandran Thanikaikarasan
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- Impact of polar (DMSO, ethanol, water) solvation on Geometry, Spectroscopy
(FT-IR, UV, NMR), Quantum chemical parameters, and the antifungal
activities of benzothiazole derivative by Molecular docking approach-
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Abstract: Publication date: Available online 18 October 2023Source: Chemical Physics ImpactAuthor(s): Obinna C. Godfrey, Imojara Anna, Suhailah W. Qader, Gopinath Sampathkumar, Theresa C. Nwoha, Musa Runde, Obianuju A. Nwokolo, Solomon O. Iyam, Godwin D. Edo, Innocent Benjamin, Hitler Louis
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- Development of 1T phase on Flower-like Molybdenum Disulfide by Ambient
Plasma for Efficient Water Splitting-
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Abstract: Publication date: Available online 18 October 2023Source: Chemical Physics ImpactAuthor(s): Gyawali Ghanashyam, Hae Kyung Jeong
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- Metal-doped fullerenes as promising drug carriers of hydroxycarbamide
anticancer: insights from density functional theory-
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Abstract: Publication date: Available online 17 October 2023Source: Chemical Physics ImpactAuthor(s): M.M. Salem-Bekhit, S. Al Zahrani, N.A. Alhabib, R.R. Maaliw, M. Da'i, M. Mirzaei
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- Impact of peanut shells, olive pomace, and plaster on the dielectric
properties of PA6-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): O. Oulidi, L. Ouachouo, M. Jerroudi, A. Nakkabi, I. Elaaraj, L. Bih, M. Fahim, N. El Moualij
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- Study of Tl-based Perovskite Materials TlZX3 (Z = Ge, Sn, Be, Sr;
X = Cl, Br, I) for Application in Scintillators: DFT and TD-DFT
Approach-
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Abstract: Publication date: Available online 15 October 2023Source: Chemical Physics ImpactAuthor(s): Pooja Sharma, Prabhat Ranjan, Tanmoy Chakraborty
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- PRESSURE EFFECT ON SOME PHYSICAL PROPERTIES OF CALCIUM OXIDE MATERIAL
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Abstract: Publication date: Available online 14 October 2023Source: Chemical Physics ImpactAuthor(s): N. Bioud, N. Benchiheub
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- Elucidation of crystal structures using Bragg's peaks and Nuclear Magnetic
Resonance chemical shifts for polymorphic forms of
(E)-4-Bromo-2-[(phenylimino)methyl]phenol-
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Abstract: Publication date: Available online 12 October 2023Source: Chemical Physics ImpactAuthor(s): B. Krishnapriya, R. Ida Malarselvi, C. Ramachandra Raja, R. Priscilla
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- Geometry optimization, impact of solvation on the spectral (FT-IR, UV,
NMR) analysis, Quantum chemical parameters, and the bioactivity of
feruloyltyramine as a potential anti-Lassa virus agent via molecular
docking-
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Abstract: Publication date: Available online 11 October 2023Source: Chemical Physics ImpactAuthor(s): Antai E. Eyo, Gulack A. Obadiah, Innocent Benjamin, Uwem O. Edet, Faith O. Akor, Elizabeth Mbim, Ani Nkang, Ibor Richard, Emmanuel Emmanuel, Oluwadamilola V. Ayoola, Godwin Joshua, Hitler Louis
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- Impact of water addition on fluctuation dynamics in viscous solvents with
varied heterogeneity: A 2D IR spectroscopic study-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): Tubai Chowdhury, Sucheta Ghosh, Akhil Pathania, Shivshankar Kore, Akhil B Mon, Srijan Chatterjee, Samadhan H. Deshmukh, Sayan Bagchi
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- An investigation of the dielectric behavior of Bi0.7La0.3FeO3 compound
under the influence of different calcination temperatures-
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Abstract: Publication date: Available online 8 October 2023Source: Chemical Physics ImpactAuthor(s): Amrutesh Kannolli, P Avinash, H Basappa
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- Room temperature magnetic ordering and in vitro antibacterial potency of
Nd3+ doped CeO2 against the pathogenic bacterial strains-
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Abstract: Publication date: Available online 8 October 2023Source: Chemical Physics ImpactAuthor(s): A. Karmakar, S. Samanta, S. Chattopadhyay, J. Banerjee, M. Nath, B.J. Sarkar, D. Raha, S. Mitra, S. Sarkar, S.K. Dash, A. Bandyopadhyay
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- The Drug Delivery of Methimazole through the Sensing Function Assessments
of BeO Fullerene-Like Particles: DFT Study-
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Abstract: Publication date: Available online 7 October 2023Source: Chemical Physics ImpactAuthor(s): M.M. Salem-Bekhit, M. Da'i, M.M. Rakhmatullaeva, M. Mirzaei, S. Al Zahrani, N.A. Alhabib
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- Construction of AgVO3/UiO-66 heterojunction for enhanced
degradation of tetracycline-
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Abstract: Publication date: Available online 6 October 2023Source: Chemical Physics ImpactAuthor(s): Min Zhu, Xiaochen Huang, Yu Zhu, Hongjiang Zhang, Shengxi Lu
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- Resonance Energy Transfer in Electrostatically Assembled Donor-Acceptor
System based on Blue-Emitting InP Quantum Dots-
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Abstract: Publication date: Available online 6 October 2023Source: Chemical Physics ImpactAuthor(s): Pradyut Roy, Adhra S. Sury, Pramod P. Pillai
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- Understanding the Influence of Ethylene Glycol on the Microscopic Behavior
of Imidazolium-based Monocationic and Dicationic Ionic Liquid-
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Abstract: Publication date: Available online 4 October 2023Source: Chemical Physics ImpactAuthor(s): Amita Mahapatra, Joyoti Ghosh, Sahadev Barik, Subhakanta Parida, Moloy Sarkar
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- Molecular structure, physicochemical properties, Impact of solvents
ionization potential, electron occupancy, inhibition constant, and
stabilization energy investigations of 4-Acetamido benzoic acid-
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Abstract: Publication date: Available online 4 October 2023Source: Chemical Physics ImpactAuthor(s): R. Rajasekar, T.S. Renuga Devi, S. Janani, M. Raja, Sunil Kumar, P. Ramesh, S. Muthu, Saleem Javed
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- Quantum computations of non-steroidal anti-inflammatory drug molecules
using Density Functional Theory-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): Prachalith NC, Vibha K, Shilpa KG, Ravikantha MN, Annoji Reddy R, Thipperudrappa J, U.V. Khadke
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- An overview of the biosensing potential of organometallic compounds
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): Durga Prasad Mishra, Biswajeet Acharya, Swarnajeet Tripathy, Binapani Barik, Prafulla Kumar Sahu
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- Synthesis, antimicrobial activity and molecular docking studies of novel
hydantoin derivatives as potential phospholipase A2 inhibitors-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): Cynthia E. Theodore, G. Sivaiah, S.B. Benaka Prasad, K. Yogesh Kumar, M.S. Raghu, Fahd Alharethy, M.K. Prashanth, Byong-Hun Jeon
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- Induction and Destruction of Folding Motifs in Cyclotides by Cyclic
Cystine Knots-
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Abstract: Publication date: Available online 3 October 2023Source: Chemical Physics ImpactAuthor(s): Jayapriya Venkatesan, Durba Roy
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- Dynamics of an inhibitor at and away from an out-of-active site binding
location in Human Carbonic Anhydrase II-
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Abstract: Publication date: Available online 2 October 2023Source: Chemical Physics ImpactAuthor(s): Satyajit Khatua, Srabani Taraphder
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- Magical moiré patterns in twisted bilayer graphene: A review on recent
advances in graphene twistronics-
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Abstract: Publication date: Available online 29 September 2023Source: Chemical Physics ImpactAuthor(s): Shreyas S. Dindorkar, Ajinkya S. Kurade, Aksh Hina Shaikh
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- Origin of rate-dispersion in translational diffusion: distinguishing
heterogeneous from homogeneous using 2D correlation analysis-
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Abstract: Publication date: Available online 28 September 2023Source: Chemical Physics ImpactAuthor(s): Ruchir Gupta, Shubham Verma, Sachin Dev Verma
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- Ab-initio study of structural, electronic, phonon, X-ray spectroscopy, and
the optoelectronic properties of d-block metals (Cr, Mn, Co, and Ni)
substitution of barium oxide based-perovskites-
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Abstract: Publication date: Available online 28 September 2023Source: Chemical Physics ImpactAuthor(s): Ededet A. Eno, Daniel Etiese, Kowthaman Pathmanathan, Ernest C. Agwamba, Udochukwu G. Chukwu, Thomas O. Magu, Alexander I. Ikeuba, Adedapo S Adeyinka, Hitler Louis
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- Recent advances in In2S3-based photocatalysts for catalytic reduction of
CO2-
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Abstract: Publication date: Available online 26 September 2023Source: Chemical Physics ImpactAuthor(s): Soumya Ranjan Mishra, Vishal Gadore, Md. Ahmaruzzaman
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- Effect of Water Models on The Stability of RNA: Role of Counter-Ions
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Abstract: Publication date: Available online 26 September 2023Source: Chemical Physics ImpactAuthor(s): Omkar Singh, Pushyaraga P Venugopal, Debashree Chakraborty
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- Fluorescence property and solvent effect on m-bromosalicylaldehyde
derivative; insights from synthesis, characterization, antimicrobial
activity and computational studies-
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Abstract: Publication date: Available online 26 September 2023Source: Chemical Physics ImpactAuthor(s): C. Geetha Priya, B.R. Venkatraman, S. Sowrirajan, N. Elangovan, Natarajan Arumugam, Abdulrahman I. Almansour, Sakkarapalayam M. Mahalingam
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- Confined environment facilitates stacked conformations in Holliday
Junction-
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Abstract: Publication date: Available online 26 September 2023Source: Chemical Physics ImpactAuthor(s): Priya Agarwal, Sahil Hasan Kabir, Nibedita Pal
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- Quantum Computational, Spectroscopic Characterization, Hirshfeld Analysis
& Molecular docking Studies on p-Toluenesulfonic Acid (p-TSA) or Tosylic
Acid-
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Abstract: Publication date: Available online 22 September 2023Source: Chemical Physics ImpactAuthor(s): Hero Khan Pathan, Ghazala Khanum, Rabia Javed, Nazia Siddiqui, S. Selvakumari, S Muthu, Akram Ali, Himanshu Arora, Mohd Afzal, Anuj Kumar, Saleem Javed
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- Role of hydrophobic side chain in urea induced protein denaturation at
interface-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): Preeti Gahtori, Vineet Gunwant, Ravindra Pandey
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- A Facile Detection of Ethanol by the Be/Mg/Ca-Enhanced Fullerenes:
Insights from Density Functional Theory-
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Abstract: Publication date: Available online 21 September 2023Source: Chemical Physics ImpactAuthor(s): F. Toiserkani, M. Mirzaei, V. Alcan, K. Harismah, M.M. Salem-Bekhit
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- The effective and sustainable application of a green amino acid-based
corrosion Inhibitor for Cu metal-
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Abstract: Publication date: Available online 18 September 2023Source: Chemical Physics ImpactAuthor(s): Abdullah Hasan Jabbar, Suhair Mohammad Husein Kamona, Sarah Kamil Abbood, Talib Kh. Hussein, Dahlia N. Al-Saidi, Safaa Mustafa Hameed, Rashid Abdul Kareem Rashid, Hussein Abdullah Abbas, Mustafa M. Kadhim
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- Theoretical investigation, solvation effect, topology, NCI and molecular
docking studies on potential Pemigatinib-
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Abstract: Publication date: Available online 18 September 2023Source: Chemical Physics ImpactAuthor(s): T. Kaviya, P. Rajkumar, N. Elangovan, T. Arulmozhi, S. Sowrirajan, Natarajan Arumugam, Abdulrahman I. Almansour, Sakkarapalayam M. Mahalingam
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- Theoretical insights into tunable electronic properties of graphene
quantum dots through ZnO doping-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): Fouad N. Ajeel, Kareem H. Mohsin, Hussein G. Shakier, Salam K. Khamees, Mohammed N. Mutier
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- Ultrafast ESIPT dynamics of 4-methyl-2,6-diformylphenol
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): Probal Nag, Sivaranjana Reddy Vennapusa
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- Molecular Docking and Dynamic Simulations of 2-phenoxyaniline and Quantum
Computational, Spectroscopic, DFT/TDDFT Investigation of Electronic States
in Various Solvents-
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Abstract: Publication date: Available online 13 September 2023Source: Chemical Physics ImpactAuthor(s): Manoj Kumar, Seraj Ahmad, Km. Garima, Akram Ali, Himanshu Arora, S. Muthu, A. Saral, Akhilesh Kumar, Mohd Afzal, Saleem Javed
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- Investigation of the potential of apigenin and kaempferol for toxic gas
sensing: A theoretical perspective-
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Abstract: Publication date: Available online 13 September 2023Source: Chemical Physics ImpactAuthor(s): Abdelmajeed Adam Lagum, Rashid Abdul Kareem Rashid, Suhair Mohammad Husein Kamona, Abrar Ryadh, Kadhum Al-Majdi, Nada Qasim Mohammed, Bahira Abdulrazzaq Mohammed, Hussein Abdullah Abbas, Shelesh Krishna Saraswat
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- A comparative investigation on the fundamental physical properties of UX2
(X= O, N, C, Si and S) solid nuclear fuel materials: A DFT+U study-
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Abstract: Publication date: Available online 12 September 2023Source: Chemical Physics ImpactAuthor(s): Minhajul Islam
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- Experimental and theoretical investigation of structure activity
relationship on L-Lysine Monohydrate for antioxidant efficacy-
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Abstract: Publication date: Available online 11 September 2023Source: Chemical Physics ImpactAuthor(s): T. Brintha, J Jeni James, M Amalanathan, P.J. Jegan Babu, M. Sony Michael Mary
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- Sensing the Formaldehyde Pollutant by an Enhanced BNC18
Fullerene: DFT Outlook-
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Abstract: Publication date: Available online 11 September 2023Source: Chemical Physics ImpactAuthor(s): M. Da'i, M. Mirzaei, F. Toiserkani, S.M. Mohealdeen, Y. Yasin, M.M.S. Bekhit, R. Akhavan-Sigari
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- ANALYSES ON THE REACTIVITY, TOPOLOGY AND BIOACTIVITY OF FLUAZINAM USING
DENSITY FUNCTIONAL THEORY-
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Abstract: Publication date: Available online 10 September 2023Source: Chemical Physics ImpactAuthor(s): R. Godwini, J. Clemy Monicka, S. Grace Victoria
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- Parthenium Hysterophorous flower template assisted SnO2 nanostructure as
photoanode for Dye Sensitized Solar Cell-
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Abstract: Publication date: Available online 10 September 2023Source: Chemical Physics ImpactAuthor(s): R. Vasanthapriya, N. Neelakandeswari, K. Uthayarani, M .Chitra
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- Structure Conformational, Molecular Docking and Computational
Investigation of Methyl Linoleate-
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Abstract: Publication date: Available online 9 September 2023Source: Chemical Physics ImpactAuthor(s): C. Prabhu, P. Rajesh, E. Dhanalakshmi, T. Gnanasambandan, M. Priyadharshini
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- Analysis of amplitude and frequency-dependent scaling behavior of dynamic
hysteresis loop and thermal properties of BaZr0.05Ti0.95O3 ceramic-
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Abstract: Publication date: Available online 7 September 2023Source: Chemical Physics ImpactAuthor(s): A. Hota, T. Badapanda, S.K. Rout, Satish B
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- Growth, Structural, Spectroscopic, DFT calculations, insilico biological
analysis of Glycine Methyl Ester Hydrochloride (GMEHCl) against Human
Estrogen Receptor-
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Abstract: Publication date: Available online 7 September 2023Source: Chemical Physics ImpactAuthor(s): N. Mahalakshmi, M. Parthasarathy
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- Nano-enhanced drug delivery of dacarbazine using heteroatoms (B, N, P, S)
doped Ag-functionalized silicene nanomaterials: Insight from density
functional theory-
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Abstract: Publication date: Available online 5 September 2023Source: Chemical Physics ImpactAuthor(s): Victoria M. Bassey, Emmanuel E.D. Okon, Hitler Louis, Innocent Benjamin, Kelechi Chukwuemeka, Terkumbur E. Gber, Miracle C. Ezekiel, Suhaila W. Qader, Adedapo S. Adeyinka
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- A Systematic Investigation of Luminescent Schiff bases: Photophysical and
DFT studies-
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Abstract: Publication date: Available online 2 September 2023Source: Chemical Physics ImpactAuthor(s): Sowmya Ramkumar, R. Kaviarasi, E. Kavyasri, G. Sathya Priyadarshini
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- Theoretical study of Fe-based biomimetic complexes interaction with
nitrogen and hydrogen: energetics, QTAIM analysis, and the performance of
xTB-
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Abstract: Publication date: Available online 1 September 2023Source: Chemical Physics ImpactAuthor(s): Andrej Hlinčík, Michal Malček, Lukáš Bučinský
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- Pd doped carbon nanotubes as a drug carrier for Gemcitabine anticancer
drug: DFT studies-
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Abstract: Publication date: Available online 31 August 2023Source: Chemical Physics ImpactAuthor(s): Fouad N. Ajeel, Kareem H. Bardan, Saja H. Kareem, Alaa M. Khudhair
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- Structural analysis, reactivity descriptors (HOMO-LUMO, ELF, NBO), effect
of polar (DMSO, EtOH, H2O) solvation, and libido-enhancing potential of
resveratrol by molecular docking-
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Abstract: Publication date: Available online 30 August 2023Source: Chemical Physics ImpactAuthor(s): Eze A. Adindu, Obinna C. Godfrey, Eyuwa I. Agwupuye, Bassey O. Ekpong, Daniel C. Agurokpon, Sopuruchukwu E. Ogbodo, Innocent Benjamin, Hitler Louis
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- Plant and Bacteria mediated synthesis of TiO2 NPs for dye
degradation in water. A review-
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Abstract: Publication date: Available online 25 August 2023Source: Chemical Physics ImpactAuthor(s): Carol Langa, Nomso C Hintsho-Mbita
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- Structural and dielectric properties of GdFeAsO ceramic material
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Abstract: Publication date: Available online 23 July 2023Source: Chemical Physics ImpactAuthor(s): Gyanendra Kumar Mishra, N.K. Mohanty, Subingya Pandey, Prafulla Kumar Pradhan, Atala Bihari Panda, Banarji Behera
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- Synthesis, spectroscopic and surface morphological investigations of
Co(II), Ni(II), Cu(II), and Zn(II) Schiff base macrocyclic complexes-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): V. Pushpanathan, S. Sahaya Jude Dhas, D. Suresh Kumar
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- Photodegradation of rhodamine B over g-C3N4-FeVO4 hetero-structured
nanocomposite under solar light irradiation-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): Chittaranjan Routray, Souman Pahi, Susanta Kumar Biswal, Shraban Kumar Sahoo
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- Effect of the annealing process on the properties of ZnO thin films
prepared by the sol-gel method-
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Abstract: Publication date: December 2023Source: Chemical Physics Impact, Volume 7Author(s): Louiza Arab, Abdelhak Amri, Afek Meftah, Aya Latif, Toufik Tibermacine, Nouraddine Sengouga
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- Investigations on capping-induced changes in structural, optical, and
thermal properties of Zn0.96Ni0.04S nanoparticles-
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Abstract: Publication date: Available online 28 June 2023Source: Chemical Physics ImpactAuthor(s): R. Mohan, C. Rakkappan, N. Punitha, K. Jayamoorthy, P. Magesan, N. Srinivasan
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- Greener Fabrication of Metal Nanoparticles Using Plant Materials: A Review
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Abstract: Publication date: Available online 24 June 2023Source: Chemical Physics ImpactAuthor(s): Ahmad Reza Bagheri, Nahal Aramesh, Md Saquib Hasnain, Amit Kumar Nayak, Rajender Singh Varma
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- SYNTHESIS, CHARACTERIZATION AND BIOLOGICAL ACTIVITY OF ZINC COMPLEXES OF
ETHYLENEDIAMINE AND ITS DERIVATIVES-
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Abstract: Publication date: Available online 8 June 2023Source: Chemical Physics ImpactAuthor(s): M. Jaya Brabha, M. Anitha Malbi
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