Ruscic B - Search Results

1

Elaborated thermochemical treatment of HF, CO, N₂, and H₂O: Insight into HEAT and its extensions.

Thorpe JH, Kilburn JL, Feller D, Changala PB, Bross DH, Ruscic B, Stanton JF. Thorpe JH, et al. Among authors: ruscic b. J Chem Phys. 2021 Nov 14;155(18):184109. doi: 10.1063/5.0069322. J Chem Phys. 2021. PMID: 34773951

2

The origin of systematic error in the standard enthalpies of formation of hydrocarbons computed via atomization schemes.

Tasi G, Izsák R, Matisz G, Császár AG, Kállay M, Ruscic B, Stanton JF. Tasi G, et al. Among authors: ruscic b. Chemphyschem. 2006 Aug 11;7(8):1664-7. doi: 10.1002/cphc.200600224. Chemphyschem. 2006. PMID: 16841354 No abstract available.

3

High-accuracy extrapolated ab initio thermochemistry. III. Additional improvements and overview.

Harding ME, Vázquez J, Ruscic B, Wilson AK, Gauss J, Stanton JF. Harding ME, et al. Among authors: ruscic b. J Chem Phys. 2008 Mar 21;128(11):114111. doi: 10.1063/1.2835612. J Chem Phys. 2008. PMID: 18361558

4

Electronic states of the quasilinear molecule propargylene (HCCCH) from negative ion photoelectron spectroscopy.

Osborn DL, Vogelhuber KM, Wren SW, Miller EM, Lu YJ, Case AS, Sheps L, McMahon RJ, Stanton JF, Harding LB, Ruscic B, Lineberger WC. Osborn DL, et al. Among authors: ruscic b. J Am Chem Soc. 2014 Jul 23;136(29):10361-72. doi: 10.1021/ja5039984. Epub 2014 Jul 10. J Am Chem Soc. 2014. PMID: 25009990

5

On the HCN - HNC Energy Difference.

Nguyen TL, Baraban JH, Ruscic B, Stanton JF. Nguyen TL, et al. Among authors: ruscic b. J Phys Chem A. 2015 Nov 5;119(44):10929-34. doi: 10.1021/acs.jpca.5b08406. Epub 2015 Oct 23. J Phys Chem A. 2015. PMID: 26447346

6

Bond Dissociation Energies for Diatomic Molecules Containing 3d Transition Metals: Benchmark Scalar-Relativistic Coupled-Cluster Calculations for 20 Molecules.

Cheng L, Gauss J, Ruscic B, Armentrout PB, Stanton JF. Cheng L, et al. Among authors: ruscic b. J Chem Theory Comput. 2017 Mar 14;13(3):1044-1056. doi: 10.1021/acs.jctc.6b00970. Epub 2017 Feb 8. J Chem Theory Comput. 2017. PMID: 28080054

7

A vacuum ultraviolet laser pulsed field ionization-photoion study of methane (CH₄): determination of the appearance energy of methylium from methane with unprecedented precision and the resulting impact on the bond dissociation energies of CH₄ and CH₄.

Chang YC, Xiong B, Bross DH, Ruscic B, Ng CY. Chang YC, et al. Among authors: ruscic b. Phys Chem Chem Phys. 2017 Apr 5;19(14):9592-9605. doi: 10.1039/c6cp08200a. Phys Chem Chem Phys. 2017. PMID: 28345688

8

Thermal Decomposition of Potential Ester Biofuels. Part I: Methyl Acetate and Methyl Butanoate.

Porterfield JP, Bross DH, Ruscic B, Thorpe JH, Nguyen TL, Baraban JH, Stanton JF, Daily JW, Ellison GB. Porterfield JP, et al. Among authors: ruscic b. J Phys Chem A. 2017 Jun 22;121(24):4658-4677. doi: 10.1021/acs.jpca.7b02639. Epub 2017 Jun 9. J Phys Chem A. 2017. PMID: 28517940

9

Enthalpy of Formation of N₂H₄ (Hydrazine) Revisited.

Feller D, Bross DH, Ruscic B. Feller D, et al. Among authors: ruscic b. J Phys Chem A. 2017 Aug 17;121(32):6187-6198. doi: 10.1021/acs.jpca.7b06017. Epub 2017 Aug 4. J Phys Chem A. 2017. PMID: 28727457

10

Active Thermochemical Tables: The Adiabatic Ionization Energy of Hydrogen Peroxide.

Changala PB, Nguyen TL, Baraban JH, Ellison GB, Stanton JF, Bross DH, Ruscic B. Changala PB, et al. Among authors: ruscic b. J Phys Chem A. 2017 Nov 22;121(46):8799-8806. doi: 10.1021/acs.jpca.7b06221. Epub 2017 Sep 25. J Phys Chem A. 2017. PMID: 28877582

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