Tranca IC - Search Results

1

Reactive Grand-Canonical Monte Carlo Simulations for Modeling Hydration of MgCl₂.

Heijmans K, Tranca IC, Chang MW, Vlugt TJH, Gaastra-Nedea SV, Smeulders DMJ. Heijmans K, et al. Among authors: tranca ic. ACS Omega. 2021 Nov 25;6(48):32475-32484. doi: 10.1021/acsomega.1c03909. eCollection 2021 Dec 7. ACS Omega. 2021. PMID: 34901597 Free PMC article.

2

First-Principles Study of Chemical Mixtures of CaCl₂ and MgCl₂ Hydrates for Optimized Seasonal Heat Storage.

Pathak AD, Tranca I, Nedea SV, Zondag HA, Rindt CCM, Smeulders DMJ. Pathak AD, et al. J Phys Chem C Nanomater Interfaces. 2017 Sep 28;121(38):20576-20590. doi: 10.1021/acs.jpcc.7b05245. Epub 2017 Aug 28. J Phys Chem C Nanomater Interfaces. 2017. PMID: 28983386 Free PMC article.

3

Gibbs Ensemble Monte Carlo for Reactive Force Fields to Determine the Vapor-Liquid Equilibrium of CO₂ and H₂O.

Heijmans K, Tranca IC, Smeulders DMJ, Vlugt TJH, Gaastra-Nedea SV. Heijmans K, et al. Among authors: tranca ic. J Chem Theory Comput. 2021 Jan 12;17(1):322-329. doi: 10.1021/acs.jctc.0c00876. Epub 2020 Dec 22. J Chem Theory Comput. 2021. PMID: 33350819 Free PMC article.

4

Mechanistic Insight into the [4 + 2] Diels-Alder Cycloaddition over First Row d-Block Cation-Exchanged Faujasites.

Rohling RY, Tranca IC, Hensen EJM, Pidko EA. Rohling RY, et al. Among authors: tranca ic. ACS Catal. 2019 Jan 4;9(1):376-391. doi: 10.1021/acscatal.8b03482. Epub 2018 Nov 27. ACS Catal. 2019. PMID: 30775064 Free PMC article.

5

An Active Alkali-Exchanged Faujasite Catalyst for p-Xylene Production via the One-Pot Diels-Alder Cycloaddition/Dehydration Reaction of 2,5-Dimethylfuran with Ethylene.

Rohling RY, Uslamin E, Zijlstra B, Tranca IC, Filot IAW, Hensen EJM, Pidko EA. Rohling RY, et al. Among authors: tranca ic. ACS Catal. 2018 Feb 2;8(2):760-769. doi: 10.1021/acscatal.7b03343. Epub 2017 Dec 7. ACS Catal. 2018. PMID: 29430331 Free PMC article.

6

Electronic Structure Analysis of the Diels-Alder Cycloaddition Catalyzed by Alkali-Exchanged Faujasites.

Rohling RY, Tranca IC, Hensen EJM, Pidko EA. Rohling RY, et al. Among authors: tranca ic. J Phys Chem C Nanomater Interfaces. 2018 Jul 5;122(26):14733-14743. doi: 10.1021/acs.jpcc.8b04409. Epub 2018 Jun 8. J Phys Chem C Nanomater Interfaces. 2018. PMID: 30018699 Free PMC article.

7

Scaling Relations for Acidity and Reactivity of Zeolites.

Liu C, Tranca I, van Santen RA, Hensen EJM, Pidko EA. Liu C, et al. J Phys Chem C Nanomater Interfaces. 2017 Oct 26;121(42):23520-23530. doi: 10.1021/acs.jpcc.7b08176. Epub 2017 Oct 6. J Phys Chem C Nanomater Interfaces. 2017. PMID: 29142616 Free PMC article.

8

How molecular is the chemisorptive bond?

van Santen RA, Tranca I. van Santen RA, et al. Phys Chem Chem Phys. 2016 Aug 3;18(31):20868-94. doi: 10.1039/c6cp01394e. Phys Chem Chem Phys. 2016. PMID: 27357949

9

Role of Adsorbed Water on Charge Carrier Dynamics in Photoexcited TiO₂.

Litke A, Su Y, Tranca I, Weber T, Hensen EJM, Hofmann JP. Litke A, et al. J Phys Chem C Nanomater Interfaces. 2017 Apr 6;121(13):7514-7524. doi: 10.1021/acs.jpcc.7b00472. Epub 2017 Mar 13. J Phys Chem C Nanomater Interfaces. 2017. PMID: 28413570 Free PMC article.

10

Tin, The Enabler-Hydrogen Diffusion into Ruthenium.

Onwudinanti C, Tranca I, Morgan T, Tao S. Onwudinanti C, et al. Nanomaterials (Basel). 2019 Jan 21;9(1):129. doi: 10.3390/nano9010129. Nanomaterials (Basel). 2019. PMID: 30669594 Free PMC article.

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