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Probing the Superfluid Response of para-Hydrogen with a Sulfur Dioxide Dopant.
Zeng T, Guillon G, Cantin JT, Roy PN. Zeng T, et al. J Phys Chem Lett. 2013 Jul 18;4(14):2391-6. doi: 10.1021/jz401188j. Epub 2013 Jul 9. J Phys Chem Lett. 2013. PMID: 26704292
We recently presented the first attempt at using an asymmetric top molecule (para-water) to probe the superfluidity of nanoclusters (of para-hydrogen) [ Zeng , T. ; Li , H. ; Roy , P.-N. J. Phys. Chem. Lett. 2013 , 4 , 18 - 22 ]. Unfortunately, para-water could not …
We recently presented the first attempt at using an asymmetric top molecule (para-water) to probe the superfluidity of nanoclusters (of para …
Langevin equation path integral ground state.
Constable S, Schmidt M, Ing C, Zeng T, Roy PN. Constable S, et al. Among authors: zeng t. J Phys Chem A. 2013 Aug 15;117(32):7461-7. doi: 10.1021/jp4015178. Epub 2013 Jun 19. J Phys Chem A. 2013. PMID: 23738885
A new post-quantization constrained propagator for rigid tops for use in path integral quantum simulations.
Guillon G, Zeng T, Roy PN. Guillon G, et al. Among authors: zeng t. J Chem Phys. 2013 Nov 14;139(18):184115. doi: 10.1063/1.4829506. J Chem Phys. 2013. PMID: 24320262
In this paper, we extend the previously introduced Post-Quantization Constraints (PQC) procedure [G. Guillon, T. Zeng, and P.-N. Roy, J. Chem. Phys. 138, 184101 (2013)] to construct approximate propagators and energy estimators for different rigid body systems, name …
In this paper, we extend the previously introduced Post-Quantization Constraints (PQC) procedure [G. Guillon, T. Zeng, and P.- …
2,445 results