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Issue Date	Title	Author(s)
1998-11-20	Phonon Softening and the Anomalous Thermal Expansion of Ag(111)	Narasimhan, Shobhana
1992-09-07	Elastic-Stress Domains and the Herringbone Reconstruction on Au(111)	Narasimhan, Shobhana; Vanderbilt, David
2008-01	Bond stiffening in small nanoclusters and its consequences for mechanical and thermal properties	Pushpa, Raghani; Waghmare, Umesh; Narasimhan, Shobhana
2015	Substrate doping: A strategy for enhancing reactivity on gold nanocatalysts by tuning sp bands	Mammen, Nisha; de Gironcoli, Stefano; Narasimhan, Shobhana
2015	Structure of Cr monolayer on Ag(001): A buried two-dimensional c(2 x 2) antiferromagnet	Das, Jayanta; Biswas, Sananda; Kundu, Asish K.; Narasimhan, Shobhana; Menon, Krishnakumar S. R.
2016	Spin-State Switching of Manganese Porphyrin by Conformational Modification	Ghosh, Dibyajyoti; Parida, Prakash; Pati, Swapan Kumar
2016	Size-selective electrocatalytic activity of (Pt)(n)/MoS2 for oxygen reduction reaction	Bothra, Pallavi; Pandey, Mohnish; Pati, Swapan Kumar
2014	Physical origins of weak H-2 binding on carbon nanostructures: Insight from ab initio studies of chemically functionalized graphene nanoribbons	Ulman, Kanchan; Bhaumik, Debarati; Wood, Brandon C.; Narasimhan, Shobhana
2014	Pressure-induced structural changes and insulator-metal transition in layered bismuth triiodide, BiI3: a combined experimental and theoretical study	Devidas, T. R.; Shekar, N. V. Chandra; Sundar, C. S.; Chithaiah, P.; Sorb, Y. A.; Bhadram, V. S.; Chandrabhas, Narayana; Pal, K.; Waghmare, Umesh V.; Rao, C. N. R.
2014	Point defects in twisted bilayer graphene: A density functional theory study	Ulman, Kanchan; Narasimhan, Shobhana