| Ab initio study of symmetrical tilt grain boundaries in bcc Fe: structural units, magnetic moments, interfacial bonding, local energy and local stress SK Bhattacharya, S Tanaka, Y Shiihara, M Kohyama Journal of Physics: Condensed Matter 25 (13), 135004, 2013 | 83 | 2013 |
| Ab initio calculations of structural and electronic properties of CdTe clusters SK Bhattacharya, A Kshirsagar Physical Review B 75 (3), 035402, 2007 | 60 | 2007 |
| Si segregation at Fe grain boundaries analyzed by ab initio local energy and local stress SK Bhattacharya, M Kohyama, S Tanaka, Y Shiihara Journal of Physics: Condensed Matter 26 (35), 355005, 2014 | 50 | 2014 |
| Ab initio perspective of the< 110> symmetrical tilt grain boundaries in bcc Fe: application of local energy and local stress SK Bhattacharya, S Tanaka, Y Shiihara, M Kohyama Journal of Materials Science 49, 3980-3995, 2014 | 48 | 2014 |
| First principle study of free and surface terminated CdTe nanoparticles SK Bhattacharya, A Kshirsagar The European Physical Journal D-Atomic, Molecular, Optical and Plasma …, 2008 | 34 | 2008 |
| Experimental and theoretical study of the effect of Si on the oxidative behavior of Ti-6Al-4V alloys K Maeda, S Suzuki, K Ueda, T Kitashima, SK Bhattacharya, R Sahara, ... Journal of Alloys and Compounds 776, 519-528, 2019 | 27 | 2019 |
| Predicting the parabolic rate constants of high-temperature oxidation of Ti alloys using machine learning SK Bhattacharya, R Sahara, T Narushima Oxidation of Metals 94 (3), 205-218, 2020 | 23 | 2020 |
| A Molecular Dynamics Study of the Role of Adatoms in SAMs of Methylthiolate on Au(111): A New Force Field Parameterized from Ab Initio Calculations GS Longo, SK Bhattacharya, S Scandolo J. Phys. Chem. C 116 (28), 14883–14891, 2012 | 22 | 2012 |
| Mechanical properties of Fe-rich Si alloy from Hamiltonian T Mohri, Y Chen, M Kohyama, S Ogata, A Saengdeejing, SK Bhattacharya, ... npj Computational Materials 3, 2017 | 21 | 2017 |
| Mechanisms of oxidation of pure and Si-segregated α-Ti surfaces SK Bhattacharya, R Sahara, S Suzuki, K Ueda, T Narushima Applied Surface Science 463, 686-692, 2019 | 12 | 2019 |
| Mechanical properties of Fe rich Fe-Si alloys: ab-initio local bulk-modulus viewpoint S Bhattacharya, M Kohyama, S Tanaka, Y Shiihara, A Saengdeejing, ... Materials Research Express 4, 116518, 2017 | 11 | 2017 |
| First principles study of oxidation of Si-segregated α-Ti(0001) surfaces SK Bhattacharya, R Sahara, T Kitashima, K Ueda, T Narushima Jpn. J. Appl. Phys 56 (12), 125701, 2017 | 11 | 2017 |
| CCl4 dissociation on the ice Ih surface: an excess electron mediated process SK Bhattacharya, JM Finn, VP Diep, F Baletto, S Scandolo Phys. Chem. Chem. Phys. 12 (40), 13034-13036, 2010 | 11 | 2010 |
| Effect of Si on the oxidation reaction of α-Ti(0 0 0 1) surface: ab initio molecular dynamics study SK Bhattacharya, R Sahara, K Ueda, T Narushima Science and Technology of Advanced Materials 18 (1), 998-1004, 2017 | 9 | 2017 |
| ECR plasma assisted deposition of zinc nanowires VS Purohit, S Dey, SK Bhattacharya, A Kshirsagar, CV Dharmadhikari, ... Nuclear Instruments and Methods in Physics Research Section B: Beam …, 2008 | 9 | 2008 |
| Excess electrons in ice: a density functional theory study SK Bhattacharya, F Inam, S Scandolo Phys. Chem. Chem. Phys. 16 (7), 3103 - 3107, 2014 | 5 | 2014 |
| Defect studies in small CdTe clusters SK Bhattacharya, A Kshirsagar The European Physical Journal D 61, 609-619, 2011 | 5 | 2011 |
| Electronegativity difference as a descriptor for the oxidation-inhibiting effect of the alloying element during the early stages of titanium oxidation K Kohli, SK Bhattacharya, K Ueda, T Narushima, R Sahara, P Ghosh Langmuir 38 (4), 1448-1457, 2022 | 4 | 2022 |
| Transferable orthogonal tight-binding parameters for ZnS and CdS SK Bhattacharya, PA Deodhar, R Viswanatha, A Kshirsagar Journal of Physics: Condensed Matter 22, 295304, 2010 | 4 | 2010 |
| Electrical characterization of zinc oxide/aluminum nitride thin film precursor field effect transistor structures: A conducting atomic force microscopy and density functional … S Dey, S Jejurikar, SK Bhattacharya, A Banerji, KP Adhi, ... Journal of Applied Physics 108 (9), 2010 | 3 | 2010 |
Anjali KshirsagarSavitribai Phule Pune UniversityVerified email at physics.unipune.ac.in
