Dr. Debesh R. Roy
机构: Department of Physics, S. V. National Institute of Technology, Surat
主页: google.com
每年引用次数
引用次数
引用: 5,823
H-指数: 34
I10-指数 : 69
出版物: 152
Aromaticity in cyclic alkali clusters
Snehadrinarayan Khatua , Debesh R. Roy , Patrick Bultinck , Manish Bhattacharjee
Physical Chemistry Chemical Physics 10 ( 18) 2461 -2474
17
2008
Biological activity of some ACAT inhibitors in the light of DFT-based quantum descriptors
Sutapa Mondal Roy , Bhumika K. Sharma , Debesh R. Roy
Structural Chemistry 30 ( 6) 2379 -2387
1
2019
A comparative DFT study on electronic, thermodynamic and optical properties of telluride compounds
Esha V. Shah , Debesh R. Roy
Computational Materials Science 88 156 -162
4
2014
Optical activity of Co-porphyrin in the light of IR and Raman spectroscopy: A critical DFT investigation.
Debesh R. Roy , Esha V. Shah , Sutapa Mondal Roy
Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 190 121 -128
31
2018
Hybrid CaS/CaSe bilayer as a wide temperature range thermoelectric material
Kaptan Rajput , Debesh R. Roy
Physica E-low-dimensional Systems & Nanostructures 119 114014
7
2020
Structure, stability, electronic and thermoelectric properties of strontium chalcogenides
Kaptan Rajput , Debesh R. Roy
Physica E-low-dimensional Systems & Nanostructures 119 113965
1
2020
Structural, electronic, vibrational, mechanical and thermoelectric properties of 2D and bulk BaX (X=O, S, Se and Te) series under DFT and BTE framework
Pankaj Kumar , Kaptan Rajput , Debesh R. Roy
Physica E-low-dimensional Systems & Nanostructures 127 114523
12
2021
On the ground state of Pd13.
Andreas M. Köster , Patrizia Calaminici , Emilio Orgaz , Debesh R. Roy
Journal of the American Chemical Society 133 ( 31) 12192 -12196
71
2011
DFT investigation on A4B4 (A=Cu, Ag; B=As, Sn) metal–semiconductor alloy clusters for potential nanomaterials
Vipin Kumar , Esha V. Shah , Debesh R. Roy
Physica E: Low-dimensional Systems and Nanostructures 68 224 -231
5
2015
Structure, electronic properties, aromaticity and dynamics of M3N@C80 and M2C2@C82 (M=Sc, Y): A density functional study
Esha V. Shah , Debesh R. Roy
Physica E: Low-dimensional Systems and Nanostructures 70 157 -164
3
2015
Sc 3 N and Sc 2 C 2 encapsulated B 40 : Smarter than its carbon analogue
Esha V. Shah , Debesh R. Roy
Physica E: Low-dimensional Systems and Nanostructures 84 354 -360
8
2016
Single-layer stanane as potential gas sensor for NO2, SO2, CO2 and NH3 under DFT investigation
Vipin Kumar , Debesh R. Roy
Physica E-low-dimensional Systems & Nanostructures 110 100 -106
38
2019
Synthesis and structure of 1-D Na6 cluster chain with short Na–Na distance: Organic like aromaticity in inorganic metal cluster
Snehadrinarayan Khatua , Debesh R. Roy , Pratim K. Chattaraj , Manish Bhattacharjee
Chemical Communications ( 2) 135 -137
26
2007
Aromaticity in alkali metal clusters: Role of the metalloligand and the size of the metal ion
Snehadrinarayan Khatua , Debesh R. Roy , Manish Bhattacharjee , Pratim K. Chattaraj
Journal of Computational Methods in Sciences and Engineering 7 ( 5) 395 -408
2007
2D PC3 as a promising thermoelectric material
Kaptan Rajput , Debesh R. Roy
Physical Chemistry Chemical Physics 22 ( 16) 8625 -8632
14
2020
Structure, electronic, optical and thermodynamic behavior on the polymerization of PMMA: A DFT investigation
Esha V. Shah , Chetna M. Patel , Debesh R. Roy
Computational Biology and Chemistry 72 192 -198
10
2018
Toxicity of polyhalogenated dibenzo-p-furans in the light of nucleic acid bases interaction.
Bhumika K. Sharma , Debesh R. Roy
Computational Biology and Chemistry 76 225 -231
2
2018
Local hardness: a critical account
Pratim K. Chattaraj , Debesh R. Roy , Paul Geerlings , Miquel Torrent-Sucarrat
Theoretical Chemistry Accounts 118 ( 5) 923 -930
69
2007
DFT study on band gap tunability in boron doped monolayer SiC
Vipin Kumar , Debesh R Roy ,
AIP Conference Proceedings 1942 ( 1) 120021
2018
Electric field-induced band modulation of predicted ternary 2D MXC3 [M:X = As:Ge, Sb:Sn and Bi:Pb] with strong stability and optical properties
Vipin Kumar , Kaptan Rajput , Debesh R. Roy
Carbon 172 791 -803
17
2021