Amit Gupta, Ph.D. - Publications
Affiliations: | Northwestern University, Evanston, IL |
Year | Citation | Score | |||
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2005 | Gupta A, Snurr RQ. A study of pore blockage in silicalite zeolite using free energy perturbation calculations. The Journal of Physical Chemistry. B. 109: 1822-33. PMID 16851164 DOI: 10.1021/Jp047391E | 0.511 | |||
2003 | Gupta A, Chempath S, Sanborn MJ, Clark LA, Snurr RQ. Object-oriented programming paradigms for molecular modeling Molecular Simulation. 29: 29-46. DOI: 10.1080/0892702031000065719 | 0.524 | |||
2000 | Gupta A, Clark LA, Snurr RQ. Grand canonical Monte Carlo simulations of nonrigid molecules: Siting and segregation in silicalite zeolite Langmuir. 16: 3910-3919. DOI: 10.1021/La990756F | 0.633 | |||
1999 | Clark LA, Ye GT, Gupta A, Hall LL, Snurr RQ. Diffusion mechanisms of normal alkanes in faujasite zeolites Journal of Chemical Physics. 111: 1209-1222. DOI: 10.1063/1.479306 | 0.627 | |||
1998 | Clark LA, Ye GT, Gupta A, Hall LL, Snurr RQ. Molecular Dynamics of Alkanes in Faujasite Zeolites Mrs Proceedings. 543: 145-150. DOI: 10.1557/Proc-543-145 | 0.62 | |||
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