Stability of nucleobases and base pairs adsorbed on graphyne and graphdiyne S Chandra Shekar, RS Swathi
The Journal of Physical Chemistry C 118 (8), 4516-4528, 2014
62 2014 Evolution of the electronic structure in open-shell donor-acceptor organic semiconductors Z Chen, W Li, MA Sabuj, Y Li, W Zhu, M Zeng, CS Sarap, MM Huda, ...
Nature Communications 12 (1), 5889, 2021
57 2021 Rattling motion of alkali metal ions through the cavities of model compounds of graphyne and graphdiyne S Chandra Shekar, RS Swathi
The Journal of Physical Chemistry A 117 (36), 8632-8641, 2013
51 2013 Molecular switching on graphyne and graphdiyne: realizing functional carbon networks in synergy with graphene SC Shekar, RS Swathi
Carbon 126, 489-499, 2018
36 2018 Cation− π interactions and rattling motion through two-dimensional carbon networks: graphene vs graphynes SC Shekar, RS Swathi
The Journal of Physical Chemistry C 119 (16), 8912-8923, 2015
32 2015 Graphynes: indispensable nanoporous architectures in carbon flatland A James, C John, C Owais, SN Myakala, SC Shekar, JR Choudhuri, ...
RSC advances 8 (41), 22998-23018, 2018
30 2018 Benzobisthiadiazole-based high-spin donor–acceptor conjugated polymers with localized spin distribution MA Sabuj, MM Huda, CS Sarap, N Rai
Materials Advances 2 (9), 2943-2955, 2021
15 2021 Optoelectronic properties of diamondoid-DNA complexes CS Sarap, P Partovi-Azar, M Fyta
ACS Applied Bio Materials 1 (1), 59-69, 2018
12 2018 Optical properties of single-and double-functionalized small diamondoids CS Sarap, B Adhikari, S Meng, F Uhlig, M Fyta
The Journal of Physical Chemistry A 122 (14), 3583-3593, 2018
12 2018 2D MoS2 nanopores: ionic current blockade height for clustering DNA events AD Carral, CS Sarap, K Liu, A Radenovic, M Fyta
2D Materials 6 (4), 045011, 2019
10 2019 Triazatruxene radical cation: a trigonal class III mixed valence system TG Thomas, SC Shekar, RS Swathi, KR Gopidas
RSC advances 7 (2), 821-825, 2017
10 2017 Enhancing the optical detection of mutants from healthy DNA with diamondoids CS Sarap, P Partovi-Azar, M Fyta
Journal of materials chemistry B 7 (21), 3424-3430, 2019
6 2019 Interlocked benzenes in triangular π-architectures: anchoring groups dictate ion binding and transmission SC Shekar, SK Meena, RS Swathi
Physical Chemistry Chemical Physics 19 (16), 10264-10273, 2017
5 2017 Diamondoid-functionalized nanogaps: from small molecules to electronic biosensing FC Maier, CS Sarap, M Dou, G Sivaraman, M Fyta
The European Physical Journal Special Topics 227, 1681-1692, 2019
3 2019 In silico Complexes of Amino Acids and Diamondoids P Partovi‐Azar, CS Sarap, M Fyta
ChemPhysChem 20 (17), 2166-2170, 2019
2 2019 Electronic properties and optical spectra of donor–acceptor conjugated organic polymers CS Sarap, Y Singh, JM Lane, N Rai
Scientific Reports 13 (1), 21587, 2023
1 2023 Domain-size effect on the electronic properties of two-dimensional CS Sarap, MH Putra, M Fyta
Physical Review B 101 (7), 075129, 2020
1 2020 Revealing the Intricate Optical Spectra of Organic Open-Shell Conjugated Polymers N Rai, C Sarap, Y Singh
APS March Meeting Abstracts 2022, M16. 007, 2022
2022 Pushing the Frontier of Organic Optoelectronics through Computational Design of Open-Shell Donor-Acceptor Macromolecules MA Sabuj, C Sarap, O Muoh, JD Teas, C Gruich, N Rai
2020 Virtual AIChE Annual Meeting, 2020
2020 
R S SwathiAssociate Professor, School of Chemistry, IISER ThiruvananthapuramDirección de correo verificada de iisertvm.ac.in
