Chass GA - Search Results

1

Structure and spectroscopy of CuH prepared via borohydride reduction.

Bennett EL, Wilson T, Murphy PJ, Refson K, Hannon AC, Imberti S, Callear SK, Chass GA, Parker SF. Bennett EL, et al. Among authors: chass ga. Acta Crystallogr B Struct Sci Cryst Eng Mater. 2015 Dec 1;71(Pt 6):608-12. doi: 10.1107/S2052520615015176. Epub 2015 Nov 7. Acta Crystallogr B Struct Sci Cryst Eng Mater. 2015. PMID: 26634717 Free PMC article.

2

How the surface structure determines the properties of CuH.

Bennett E, Wilson T, Murphy PJ, Refson K, Hannon AC, Imberti S, Callear SK, Chass GA, Parker SF. Bennett E, et al. Among authors: chass ga. Inorg Chem. 2015 Mar 2;54(5):2213-20. doi: 10.1021/ic5027009. Epub 2015 Feb 11. Inorg Chem. 2015. PMID: 25671787 Free article.

3

CO2-mineralization and carbonation reactor rig: Design and validation for in situ neutron scattering experiments-Engineering and lessons learned.

Mortazavi A, Song F, Dudman M, Evans M, Copcutt R, Romanelli G, Demmel F, Farrar DH, Parker SF, Tian KV, Di Tommaso D, Chass GA. Mortazavi A, et al. Among authors: chass ga. Rev Sci Instrum. 2023 Sep 1;94(9):093905. doi: 10.1063/5.0136204. Rev Sci Instrum. 2023. PMID: 37724925

4

Penicillin's catalytic mechanism revealed by inelastic neutrons and quantum chemical theory.

Mucsi Z, Chass GA, Ábrányi-Balogh P, Jójárt B, Fang DC, Ramirez-Cuesta AJ, Viskolcz B, Csizmadia IG. Mucsi Z, et al. Among authors: chass ga. Phys Chem Chem Phys. 2013 Dec 21;15(47):20447-20455. doi: 10.1039/c3cp50868d. Epub 2013 Jun 12. Phys Chem Chem Phys. 2013. PMID: 23760063

5

Atomic and vibrational origins of mechanical toughness in bioactive cement during setting.

Tian KV, Yang B, Yue Y, Bowron DT, Mayers J, Donnan RS, Dobó-Nagy C, Nicholson JW, Fang DC, Greer AL, Chass GA, Greaves GN. Tian KV, et al. Among authors: chass ga. Nat Commun. 2015 Nov 9;6:8631. doi: 10.1038/ncomms9631. Nat Commun. 2015. PMID: 26548704 Free PMC article.

6

A Database of Solution Additives Promoting Mg²⁺ Dehydration and the Onset of MgCO₃ Nucleation.

Toroz D, Song F, Uddin A, Chass GA, Di Tommaso D. Toroz D, et al. Among authors: chass ga. Cryst Growth Des. 2022 May 4;22(5):3080-3089. doi: 10.1021/acs.cgd.1c01525. Epub 2022 Apr 5. Cryst Growth Des. 2022. PMID: 35529066 Free PMC article.

7

Flexibility of "polyunsaturated fatty acid chains" and peptide backbones: A comparative ab initio study.

Law JM, Setiadi DH, Chass GA, Csizmadia IG, Viskolcz B. Law JM, et al. Among authors: chass ga. J Phys Chem A. 2005 Jan 27;109(3):520-33. doi: 10.1021/jp040546y. J Phys Chem A. 2005. PMID: 16833374

8

First principle computational study on the full conformational space of L-proline diamides.

Sahai MA, Kehoe TA, Koo JC, Setiadi DH, Chass GA, Viskolcz B, Penke B, Pai EF, Csizmadia IG. Sahai MA, et al. Among authors: chass ga. J Phys Chem A. 2005 Mar 24;109(11):2660-79. doi: 10.1021/jp040594i. J Phys Chem A. 2005. PMID: 16833573

9

Characterization of the conformational probability of N-acetyl-phenylalanyl-NH2 by RHF, DFT, and MP2 computation and AIM analyses, confirmed by jet-cooled infrared data.

Chass GA, Mirasol RS, Setiadi DH, Tang TH, Chin W, Mons M, Dimicoli I, Dognon JP, Viskolcz B, Lovas S, Penke B, Csizmadia IG. Chass GA, et al. J Phys Chem A. 2005 Jun 23;109(24):5289-302. doi: 10.1021/jp040720i. J Phys Chem A. 2005. PMID: 16839052

10

A quantitative scale for the extent of conjugation of the amide bond. Amidity percentage as a chemical driving force.

Mucsi Z, Tsai A, Szori M, Chass GA, Viskolcz B, Csizmadia IG. Mucsi Z, et al. Among authors: chass ga. J Phys Chem A. 2007 Dec 20;111(50):13245-54. doi: 10.1021/jp0759325. Epub 2007 Nov 28. J Phys Chem A. 2007. PMID: 18041826

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