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Dr. Sk. Musharaf Ali
Dr. Sk. Musharaf Ali
Scientist, Computational and Theoretical chemistry, Bhabha Atomic Research Centre
Verified email at barc.gov.in
Title
Cited by
Cited by
Year
Universal scaling laws of diffusion in a binary fluid mixture
A Samanta, SM Ali, SK Ghosh
Physical review letters 87 (24), 245901, 2001
1132001
Novel amidoamine functionalized multi-walled carbon nanotubes for removal of mercury (II) ions from wastewater: combined experimental and density functional theoretical approach
AKS Deb, V Dwivedi, K Dasgupta, SM Ali, KT Shenoy
Chemical Engineering Journal 313, 899-911, 2017
892017
New universal scaling laws of diffusion and Kolmogorov-Sinai entropy in simple liquids
A Samanta, SM Ali, SK Ghosh
Physical review letters 92 (14), 145901, 2004
732004
Plasmons with orbital angular momentum
JT Mendonca, S Ali, B Thidé
Physics of Plasmas 16 (11), 2009
722009
Complexation thermodynamics of diglycolamide with f-elements: solvent extraction and density functional theory analysis
SM Ali, S Pahan, A Bhattacharyya, PK Mohapatra
Physical Chemistry Chemical Physics 18 (14), 9816-9828, 2016
642016
Ab initio and density functional theoretical design and screening of model crown ether based ligand (host) for extraction of lithium metal ion (guest): effect of donor …
A Boda, SM Ali, H Rao, SK Ghosh
Journal of molecular modeling 18, 3507-3522, 2012
642012
Preferential interaction of charged alkali metal ions (guest) within a narrow cavity of cyclic crown ethers (neutral host): a quantum chemical investigation
S De, A Boda, SM Ali
Journal of Molecular Structure: THEOCHEM 941 (1-3), 90-101, 2010
632010
DFT modeling on the suitable crown ether architecture for complexation with Cs+ and Sr2+ metal ions
A Boda, SM Ali, MRK Shenoi, H Rao, SK Ghosh
Journal of molecular modeling 17, 1091-1108, 2011
622011
Mode coupling theory of self and cross diffusivity in a binary fluid mixture: Application to Lennard-Jones systems
SM Ali, A Samanta, SK Ghosh
The Journal of Chemical Physics 114 (23), 10419-10429, 2001
61*2001
Surface engineering of PAMAM-SDB chelating resin with diglycolamic acid (DGA) functional group for efficient sorption of U (VI) and Th (IV) from aqueous medium
P Ilaiyaraja, AKS Deb, D Ponraju, SM Ali, B Venkatraman
Journal of hazardous materials 328, 1-11, 2017
602017
Density functional theoretical analysis of structure, bonding, interaction and thermodynamic selectivity of hexavalent uranium (UO2 2+) and tetravalent plutonium (Pu …
S Pahan, A Boda, SM Ali
Theoretical Chemistry Accounts 134, 1-16, 2015
582015
An amide functionalized task specific carbon nanotube for the sorption of tetra and hexa valent actinides: experimental and theoretical insight
A Sengupta, J Sk, A Boda, SM Ali
RSC advances 6 (46), 39553-39562, 2016
552016
Novel Ag/cellulose-doped CeO2 quantum dots for efficient dye degradation and bactericidal activity with molecular docking study
M Ikram, S Hayat, M Imran, A Haider, S Naz, A Ul-Hamid, I Shahzadi, ...
Carbohydrate polymers 269, 118346, 2021
542021
Benzene-centered tripodal diglycolamides: synthesis, metal ion extraction, luminescence spectroscopy, and DFT studies
A Leoncini, SA Ansari, PK Mohapatra, A Boda, SM Ali, A Sengupta, ...
Dalton Transactions 46 (5), 1431-1438, 2017
542017
Density Functional Theoretical Investigation of Remarkably High Selectivity of the Cs+ Ion over the Na+ Ion toward Macrocyclic Hybrid Calix-Bis-Crown Ether
A Boda, MA Sheikh
The Journal of Physical Chemistry A 116 (33), 8615-8623, 2012
432012
Micro-solvation of the Zn 2+ ion—a case study
S De, SM Ali, A Ali, VG Gaikar
Physical Chemistry Chemical Physics 11 (37), 8285-8294, 2009
382009
Passage of TBP–uranyl complexes from aqueous–organic interface to the organic phase: insights from molecular dynamics simulation
P Sahu, SM Ali, KT Shenoy
Physical Chemistry Chemical Physics 18 (34), 23769-23784, 2016
372016
Phonons with orbital angular momentum
MK Ayub, S Ali, JT Mendonca
Physics of Plasmas 18 (10), 2011
372011
Molecular docking and DFT analyses of magnetic cobalt doped MoS2 and BN nanocomposites for catalytic and antimicrobial explorations
A Raza, JZ Hassan, M Ikram, S Naz, A Haider, A Ul-Hamid, I Shahzadi, ...
Surfaces and Interfaces 27, 101571, 2021
352021
Carbon nano tubes functionalized with novel functional group-amido-amine for sorption of actinides
AKS Deb, S Pahan, K Dasgupta, S Panja, AK Debnath, PS Dhami, SM Ali, ...
Journal of Hazardous Materials 345, 63-75, 2018
352018
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Articles 1–20