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@article{Varghese201717969,
title = {Insights into the C-H Bond Activation on NiO Surfaces: The Role of Nickel and Oxygen Vacancies and of Low Valent Dopants on the Reactivity and Energetics},
author = {J J Varghese and S H Mushrif},
url = {https://www.scopus.com/inward/record.uri?eid=2-s2.0-85028358931&doi=10.1021%2facs.jpcc.7b05226&partnerID=40&md5=909af0c57492975ff769b5bbefa4edcb},
doi = {10.1021/acs.jpcc.7b05226},
issn = {19327447},
year = {2017},
date = {2017-01-01},
journal = {Journal of Physical Chemistry C},
volume = {121},
number = {33},
pages = {17969-17981},
publisher = {American Chemical Society},
keywords = {},
pubstate = {published},
tppubtype = {article}
}

@article{Varghese20163984,
title = {Insights into the synergistic role of metal-lattice oxygen site pairs in four-centered C-H bond activation of methane: The case of CuO},
author = {J J Varghese and Q T Trinh and S H Mushrif},
url = {https://www.scopus.com/inward/record.uri?eid=2-s2.0-84973137234&doi=10.1039%2fc5cy01784j&partnerID=40&md5=a331e2f48e368da01b2f9ade43838aaf},
doi = {10.1039/c5cy01784j},
issn = {20444753},
year = {2016},
date = {2016-01-01},
journal = {Catalysis Science and Technology},
volume = {6},
number = {11},
pages = {3984-3996},
publisher = {Royal Society of Chemistry},
keywords = {},
pubstate = {published},
tppubtype = {article}
}

@article{Varghese2015,
title = {First-principles investigation of the dissociation and coupling of methane on small copper clusters: Interplay of collision dynamics and geometric and electronic effects},
author = {J J Varghese and S H Mushrif},
url = {https://www.scopus.com/inward/record.uri?eid=2-s2.0-84929577155&doi=10.1063%2f1.4919948&partnerID=40&md5=98b9756578ca00c225d768144940aeb3},
doi = {10.1063/1.4919948},
issn = {00219606},
year = {2015},
date = {2015-01-01},
journal = {Journal of Chemical Physics},
volume = {142},
number = {18},
publisher = {American Institute of Physics Inc.},
keywords = {},
pubstate = {published},
tppubtype = {article}
}

@article{Mushrif20154961,
title = {Solvation dynamics and energetics of intramolecular hydride transfer reactions in biomass conversion},
author = {S H Mushrif and J J Varghese and C B Krishnamurthy},
url = {https://www.scopus.com/inward/record.uri?eid=2-s2.0-84923895120&doi=10.1039%2fc4cp05063k&partnerID=40&md5=d53401897393469e56f9f1ecc4ad5014},
doi = {10.1039/c4cp05063k},
issn = {14639084},
year = {2015},
date = {2015-01-01},
journal = {Physical chemistry chemical physics : PCCP},
volume = {17},
number = {7},
pages = {4961-4969},
keywords = {},
pubstate = {published},
tppubtype = {article}
}

@article{Mushrif201419564,
title = {Insights into the Cr(iii) catalyzed isomerization mechanism of glucose to fructose in the presence of water using ab initio molecular dynamics},
author = {S H Mushrif and J J Varghese and D G Vlachos},
url = {https://www.scopus.com/inward/record.uri?eid=2-s2.0-84906539403&doi=10.1039%2fc4cp02095b&partnerID=40&md5=1df0e2d3a07702690a6e9e228bbb183b},
doi = {10.1039/c4cp02095b},
issn = {14639076},
year = {2014},
date = {2014-01-01},
journal = {Physical Chemistry Chemical Physics},
volume = {16},
number = {36},
pages = {19564-19572},
keywords = {},
pubstate = {published},
tppubtype = {article}
}