Aseem Rajan Kshirsagar

Publications

Article dans une revue (6)

Flipping of electronic spins in BiFeO3 via chiral d-d excitations Aseem Rajan Kshirsagar,Sven Reichardt Physical Review B, 2025, 112 (12), pp.L121111. ⟨10.1103/ht4g-7vb5⟩ Article dans une revue hal-05294471v1
Reconfigurable Multifunctional van der Waals Ferroelectric Devices and Logic Circuits Ankita Ram,Krishna Maity,Cédric Marchand,Aymen Mahmoudi,Aseem Rajan Kshirsagaret al. ACS Nano, 2023, 17 (21), pp.21865-21877. ⟨10.1021/acsnano.3c07952⟩ Article dans une revue hal-04300296v1
Strongly Bound Excitons in Metal–Organic Framework MOF-5: A Many-Body Perturbation Theory Study Aseem Rajan Kshirsagar,Xavier Blase,Claudio Attaccalite,Roberta Poloni Journal of Physical Chemistry Letters, 2021, 12 (16), pp.4045-4051. ⟨10.1021/acs.jpclett.1c00543⟩ Article dans une revue hal-03359643v1
Bethe–Salpeter Study of the Optical Absorption of trans and cis Azobenzene-Functionalized Metal–Organic Frameworks Using Molecular and Periodic Models Aseem Rajan Kshirsagar,Claudio Attaccalite,Xavier Blase,Jing Li,Roberta Poloni Journal of Physical Chemistry C, 2021, 125 (13), pp.7401-7412. ⟨10.1021/acs.jpcc.1c00367⟩ Article dans une revue hal-03359630v1
Accurate Prediction of the S 1 Excitation Energy in Solvated Azobenzene Derivatives via Embedded Orbital-Tuned Bethe-Salpeter Calculations Aseem Rajan Kshirsagar,Gabriele D’avino,Xavier Blase,Jing Li,Roberta Poloni Journal of Chemical Theory and Computation, 2020, 16 (4), pp.2021-2027. ⟨10.1021/acs.jctc.9b01257⟩ Article dans une revue hal-02503936v1
Tuning Gas Adsorption by Metal Node Blocking in Photoresponsive Metal-Organic Frameworks Chi-Ta Yang,Aseem Rajan Kshirsagar,Azzam Charaf Eddin,Li-Chiang Lin,Roberta Poloni Chemistry - A European Journal, 2018, 24 (57), pp.15167-15172. ⟨10.1002/chem.201804014⟩ Article dans une revue hal-01946776v1

Pré-publication, Document de travail (1)

Theoretical approaches to Fröhlich excitonic polarons in polar semiconductors Jacky Even,Simon Thebaud,Aseem Rajan Kshirsagar,Zeli Xu,Laurent Pedesseauet al. 2025 Pré-publication, Document de travail hal-05344812v1

Communication dans un congrès (2)

Optical properties of molecular photoswitches and metal-organic frameworks: a GW/BSE perspective Roberta Poloni,Aseem Rajan Kshirsagar ETSF webinar, Jan 2023, Web Conference, France Communication dans un congrès hal-04924343v1
Photoswitching metal-organic frameworks for efficient gas capture-and-release applications Roberta Poloni,Aseem Rajan Kshirsagar,Xavier Blase,Claudio Attaccalite Computing Pi-Conjugated Compounds, Feb 2022, Grenoble, France Communication dans un congrès hal-04924335v1

Thèse (1)

Ab initio study of the excited state properties of azobenzene-functionalized photoresponsive MOFs Aseem Rajan Kshirsagar Material chemistry. Université Grenoble Alpes [2020-..], 2021. English. ⟨NNT : 2021GRALI039⟩ Thèse tel-03411103v1