Soft computing in chemical and physical sciences: a shift in computing paradigm K Sarkar, SP Bhattacharyya CRC Press, 2017 | 15 | 2017 |
Flying onto global minima on potential energy surfaces: A swarm intelligence guided route to molecular electronic structure R Shukla, D Ray, K Sarkar, M Kumar Dixit, S Prasad Bhattacharyya International Journal of Quantum Chemistry 117 (5), e25328, 2017 | 13 | 2017 |
Blending determinism with evolutionary computing: Applications to the calculation of the molecular electronic structure of polythiophene K Sarkar, R Sharma, SP Bhattacharyya Journal of Chemical Theory and Computation 6 (3), 718-726, 2010 | 11 | 2010 |
Evolutionary optimization of PAW data-sets for accurate high pressure simulations K Sarkar, M Topsakal, NAW Holzwarth, RM Wentzcovitch Journal of Computational Physics 347, 39-55, 2017 | 10 | 2017 |
Thermoelasticity of Iron‐ and Aluminum‐Bearing MgSiO3 Postperovskite G Shukla, K Sarkar, RM Wentzcovitch Journal of Geophysical Research: Solid Earth 124 (3), 2417-2427, 2019 | 9 | 2019 |
A constrained variational approach to the designing of low transport band gap materials: A multiobjective random mutation hill climbing method K Sarkar, R Sharma, SP Bhattacharyya International Journal of Quantum Chemistry 112 (6), 1547–1558, 2012 | 9 | 2012 |
Single string based global optimizer for geometry optimization in strongly coupled finite clusters: An adaptive mutation-driven strategy K Sarkar, SP Bhattacharyya The Journal of Chemical Physics 139 (7), 2013 | 8 | 2013 |
Frequency dependent linear and non-linear response properties of electron impurity doped quantum dots: Influence of impurity location K Sarkar, NK Datta, M Ghosh Physica E: Low-dimensional Systems and Nanostructures 42 (5), 1659-1666, 2010 | 8 | 2010 |
Dynamics of electron impurity doped quantum dots in the presence of time-varying fields: influence of impurity location K Sarkar, NK Datta, M Ghosh Physica E: Low-dimensional Systems and Nanostructures 43 (1), 345-353, 2010 | 7 | 2010 |
Interplay between size and impurity position of doped quantum dot K Sarkar, NK Datta, M Ghosh Superlattices and Microstructures 50 (1), 69-79, 2011 | 5 | 2011 |
Computationally efficient algorithm in cluster geometry optimization K Sarkar, SP Bhattacharyya AIP Conference Proceedings 1512 (1), 162-163, 2013 | 4 | 2013 |
EPAW-1.0 code for evolutionary optimization of PAW datasets especially for high-pressure applications K Sarkar, NAW Holzwarth, RM Wentzcovitch Computer Physics Communications 233, 110-122, 2018 | 3 | 2018 |
Orbital-ordered ferromagnetic insulating state in tensile-strained SrCoO thin films SC Huang, K Sarkar, RM Wentzcovitch, H Hsu arXiv preprint arXiv:2211.10404, 2022 | 2 | 2022 |
The postperovskite transition in Fe-and Al-bearing bridgmanite: effects on seismic observables JJ Valencia-Cardona, RM Wentzcovitch, J Zhuang, G Shukla, K Sarkar arXiv preprint arXiv:2208.12207, 2022 | 2 | 2022 |
Understanding of the Photodetachment Spectrum of Anionic Mixed Carbon–Boron Cluster C3B5– Following Adiabatic and Nonadiabatic Quantum Chemistry … A Kumar, K Srikanth, K Sarkar, R Sarkar, TR Rao The Journal of Physical Chemistry A 126 (28), 4563-4576, 2022 | 2 | 2022 |
The Post‐Perovskite Transition in Fe‐and Al‐Bearing Bridgmanite: Effects on Seismic Observables RM Wentzcovitch, JJ Valencia‐Cardona, J Zhuang, G Shukla, K Sarkar Journal of Geophysical Research: Solid Earth 128 (3), e2022JB025475, 2023 | 1 | 2023 |
Pure and Hybrid Evolutionary Computing in Global Optimization of Chemical Structures: from Atoms and Molecules to Clusters and Crystals K Sarkar, SP Bhattacharyya arXiv preprint arXiv:1509.00028, 2015 | 1 | 2015 |
Unraveling the intricacies of surface salt formation on Mg (0001): Implications for chloride-ion batteries K Sarkar, D Hübner, D Stottmeister, A Groß Physical Review Materials 8 (1), 015401, 2024 | | 2024 |
Orbital-ordered ferromagnetic insulating state in tensile-strained SrCoO3 thin films H Hsu, SC Huang, K Sarkar, R Wentzcovitch APS March Meeting Abstracts 2023, G54. 003, 2023 | | 2023 |
The post-perovskite transition in Fe-and Al-bearing bridgmanite J Zhuang, JJ Valencia-Cardona, R Wentzcovitch, G Shukla, K Sarkar AGU Fall Meeting Abstracts 2022, MR14A-02, 2022 | | 2022 |