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Results 1-10 of 35 (Search time: 0.001 seconds).
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Issue DateTitleAuthor(s)
2015Substrate doping: A strategy for enhancing reactivity on gold nanocatalysts by tuning sp bandsMammen, Nisha; de Gironcoli, Stefano; Narasimhan, Shobhana
2015Graphene oxide as an optimal candidate material for methane storageChouhan, Rajiv K.; Ulman, Kanchan; Narasimhan, Shobhana
2015Study of critical dynamics in fluids via molecular dynamics in canonical ensembleRoy, Sutapa; Das, Subir K.
2015Unraveling the success and failure of mode coupling theory from consideration of entropyNandi, Manoj Kumar; Banerjee, Atreyee; Sengupta, Shiladitya; Sastry, Srikanth; Bhattacharyya, Sarika Maitra
2015Atomistic simulations of liquid-liquid coexistence in confinement: comparison of thermodynamics and kinetics with bulkDas, Subir K.
2015Clean WS2 and MoS2 Nanoribbons Generated by Laser-Induced Unzipping of the NanotubesVasu, Kuraganti; Yamijala, Sharma S. R. K. C.; Zak, Alla; Gopalakrishnan, Kothandam; Pati, Swapan Kumar; Rao, C. N. R.
2015Linear and Nonlinear Optical Properties of Graphene Quantum Dots: A Computational StudyYamijala, Sharma S. R. K. C.; Mukhopadhyay, Madhuri; Pati, Swapan Kumar
2015Photophysical properties of charge transfer pairs encapsulated inside macrocycle cage: A density functional theory studyBandyopadhyay, Arkamita; Pati, Swapan Kumar
2015Accuracy of Current All-Atom Force-Fields in Modeling Protein Disordered StatesPalazzesi, Ferruccio; Prakash, Meher K.; Bonomi, Massimiliano; Barducci, Alessandro
2015Kinetic and Thermodynamic Fragilities of Square Well Fluids with Tunable Barriers to Bond BreakingParmar, Anshul D. S.; Sastry, Srikanth

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