Year |
Citation |
Score |
2020 |
Walton JR, Rivera-Rivera LA. Beyond Born−Oppenheimer: A canonical perspective Chemical Physics. 530: 110616. DOI: 10.1016/J.Chemphys.2019.110616 |
0.456 |
|
2019 |
Rivera-Rivera LA, Wagner AF, Perry JW. Normal mode analysis on the relaxation of an excited nitromethane molecule in argon bath. The Journal of Chemical Physics. 151: 034303. PMID 31325951 DOI: 10.1063/1.5099050 |
0.362 |
|
2019 |
Walton JR, Rivera-Rivera LA, Lucchese RR, Bevan JW. Canonical Approach To Generate Multidimensional Potential Energy Surfaces. The Journal of Physical Chemistry. A. PMID 30607945 DOI: 10.1021/Acs.Jpca.8B10329 |
0.56 |
|
2018 |
Rivera-Rivera LA, Hren ZR. Compound-model morphed potential for the hydrogen bond HCN⋯HF Molecular Physics. 117: 539-546. DOI: 10.1080/00268976.2018.1527046 |
0.303 |
|
2018 |
Rivera-Rivera LA, McElmurry BA, Scott KW, Springer SD, Lucchese RR, Bevan JW, Leonov II, Coudert LH. 6.2 μm spectrum and 6-dimensional morphed potentials of OC-H2O Chemical Physics. 501: 35-45. DOI: 10.1016/J.Chemphys.2017.11.003 |
0.618 |
|
2017 |
Walton JR, Rivera-Rivera LA, Lucchese RR, Bevan JW. Is there any fundamental difference between ionic, covalent, and others types of bond? A canonical perspective on the question. Physical Chemistry Chemical Physics : Pccp. PMID 28589191 DOI: 10.1039/C7Cp02407J |
0.55 |
|
2016 |
Walton JR, Rivera-Rivera LA, Lucchese RR, Bevan JW. On the Morse, Lennard-Jones, and Kratzer Potentials: A Canonical Perspective with Applications. The Journal of Physical Chemistry. A. PMID 27676168 DOI: 10.1021/Acs.Jpca.6B05371 |
0.611 |
|
2016 |
Walton JR, Rivera-Rivera LA, Lucchese RR, Bevan JW. Canonical Force Distributions in Pairwise Interatomic Interactions from the Perspective of the Hellmann-Feynman Theorem. The Journal of Physical Chemistry. A. PMID 27143175 DOI: 10.1021/Acs.Jpca.6B03343 |
0.595 |
|
2016 |
Walton JR, Rivera-Rivera LA, Lucchese RR, Bevan JW. A canonical approach to forces in molecules Chemical Physics. 474: 52-58. DOI: 10.1016/J.Chemphys.2016.04.009 |
0.604 |
|
2016 |
Walton JR, Rivera-Rivera LA, Lucchese RR, Bevan JW. A canonical approach to multi-dimensional van der Waals, hydrogen-bonded, and halogen-bonded potentials Chemical Physics. 469: 60-64. DOI: 10.1016/J.Chemphys.2016.01.011 |
0.609 |
|
2015 |
Walton JR, Rivera-Rivera LA, Lucchese RR, Bevan JW. Canonical Potentials and Spectra within the Born-Oppenheimer Approximation. The Journal of Physical Chemistry. A. 119: 6753-8. PMID 26039880 DOI: 10.1021/Acs.Jpca.5B04008 |
0.63 |
|
2015 |
Walton JR, Rivera-Rivera LA, Lucchese RR, Bevan JW. A general transformation to canonical form for potentials in pairwise interatomic interactions. Physical Chemistry Chemical Physics : Pccp. 17: 14805-10. PMID 25978527 DOI: 10.1039/C5Cp01543J |
0.664 |
|
2015 |
Rivera-Rivera LA, Wagner AF, Sewell TD, Thompson DL. Pressure effects on the relaxation of an excited nitromethane molecule in an argon bath. The Journal of Chemical Physics. 142: 014303. PMID 25573557 DOI: 10.1063/1.4904314 |
0.342 |
|
2015 |
Khanpour M, Rivera-Rivera LA, Sewell TD. On statistical mechanics of small systems: accurate analytical equation of state for confined fluids Physics and Chemistry of Liquids. 53: 467-480. DOI: 10.1080/00319104.2015.1006631 |
0.329 |
|
2015 |
Walton JR, Rivera-Rivera LA, Lucchese RR, Bevan JW. From H2+ to the multidimensional potential of the intermolecular interaction Ar·HBr: A canonical approach Chemical Physics Letters. 639: 63-66. DOI: 10.1016/J.Cplett.2015.08.060 |
0.631 |
|
2014 |
Lucchese RR, Rosales CK, Rivera-Rivera LA, McElmurry BA, Bevan JW, Walton JR. A unified perspective on the nature of bonding in pairwise interatomic interactions. The Journal of Physical Chemistry. A. 118: 6287-98. PMID 25051010 DOI: 10.1021/Jp505985X |
0.655 |
|
2014 |
Rivera-Rivera LA, Siavosh-Haghighi A, Sewell TD, Thompson DL. A molecular dynamics study of the relaxation of an excited molecule in crystalline nitromethane Chemical Physics Letters. 608: 120-125. DOI: 10.1016/J.Cplett.2014.05.065 |
0.344 |
|
2013 |
Rivera-Rivera LA, McElmurry BA, Scott KW, Lucchese RR, Bevan JW. The Badger-Bauer rule revisited: correlation of proper blue frequency shifts in the OC hydrogen acceptor with morphed hydrogen bond dissociation energies in OC-HX (X = F, Cl, Br, I, CN, CCH). The Journal of Physical Chemistry. A. 117: 8477-83. PMID 23895042 DOI: 10.1021/Jp4058516 |
0.632 |
|
2013 |
Rivera-Rivera LA, Sewell TD, Thompson DL. Post-shock relaxation in crystalline nitromethane. The Journal of Chemical Physics. 138: 084512. PMID 23464165 DOI: 10.1063/1.4792438 |
0.354 |
|
2013 |
Wagner AF, Rivera-Rivera LA, Bachellerie D, Perry JW, Thompson DL. A classical trajectory study of the dissociation and isomerization of C2H5. The Journal of Physical Chemistry. A. 117: 11624-39. PMID 23448205 DOI: 10.1021/Jp3099889 |
0.41 |
|
2013 |
Rivera-Rivera LA, Scott KW, McElmurry BA, Lucchese RR, Bevan JW. Compound model-morphed potentials contrasting OC-79Br 35Cl with the halogen bonded OC-35Cl2 and hydrogen-bonded OC-HX (X = 19F, 35Cl, 79Br) Chemical Physics. 425: 162-169. DOI: 10.1016/J.Chemphys.2013.08.016 |
0.656 |
|
2012 |
Springer SD, Rivera-Rivera LA, McElmurry BA, Wang Z, Leonov II, Lucchese RR, Legon AC, Bevan JW. CMM-RS potential for characterization of the properties of the halogen-bonded OC-Cl2 complex, and a comparison with hydrogen-bonded OC-HCl. The Journal of Physical Chemistry. A. 116: 1213-23. PMID 22176491 DOI: 10.1021/Jp209870X |
0.661 |
|
2012 |
Rivera-Rivera LA, McElmurry BA, Lucchese RR, Bevan JW. Predicted properties of the CO-HF isomer using a six-dimensional morphed potential Journal of Molecular Structure. 1023: 43-48. DOI: 10.1016/J.Molstruc.2012.03.046 |
0.614 |
|
2012 |
Rivera-Rivera LA, McElmurry BA, Wang Z, Leonov II, Lucchese RR, Bevan JW. Morphed intermolecular potential of OC:HCCH complex based on infrared quantum cascade laser spectroscopy Chemical Physics Letters. 522: 17-22. DOI: 10.1016/J.Cplett.2011.11.072 |
0.588 |
|
2012 |
McElmurry BA, Rivera-Rivera LA, Scott KW, Wang Z, Leonov II, Lucchese RR, Bevan JW. Studies of low-frequency intermolecular hydrogen-bonded vibrations using a continuous supersonic slit jet mid-infrared quantum cascade laser spectrometer Chemical Physics. 409: 1-10. DOI: 10.1016/J.Chemphys.2012.09.012 |
0.64 |
|
2011 |
McElmurry BA, Rivera-Rivera LA, Scott KW, Lucchese RR, Wang Z, Leonov I, Legon AC, Bevan JW. Infrared quantum cascade laser spectroscopy of low frequency vibrations of intermolecular complexes Irmmw-Thz 2011 - 36th International Conference On Infrared, Millimeter, and Terahertz Waves. DOI: 10.1109/irmmw-THz.2011.6104772 |
0.478 |
|
2011 |
Rivera-Rivera LA, Wang Z, McElmurry BA, Lucchese RR, Bevan JW, Kanschat G. Morphing a vibrationally-complete ground state potential for the hydrogen bond OC-HF Chemical Physics. 390: 42-50. DOI: 10.1016/J.Chemphys.2011.10.001 |
0.683 |
|
2010 |
Rivera-Rivera LA, Wang Z, McElmurry BA, Willaert FF, Lucchese RR, Bevan JW, Suenram RD, Lovas FJ. A ground state morphed intermolecular potential for the hydrogen bonded and van der Waals isomers in OC:HI and a prediction of an anomalous deuterium isotope effect. The Journal of Chemical Physics. 133: 184305. PMID 21073221 DOI: 10.1063/1.3505145 |
0.635 |
|
2010 |
Rivera-Rivera LA, Lucchese RR, Bevan JW. A four-dimensional compound-model morphed potential for the OC:HBr complex. Physical Chemistry Chemical Physics : Pccp. 12: 7258-65. PMID 20495732 DOI: 10.1039/C000972E |
0.603 |
|
2008 |
Rivera-Rivera LA, Lucchese RR, Bevan JW. A parameterized compound-model chemistry for morphing the intermolecular potential of OC-HCl Chemical Physics Letters. 460: 352-358. DOI: 10.1016/J.Cplett.2008.05.083 |
0.576 |
|
2007 |
Jabs W, Willaert FF, McElmurry BA, Rivera-Rivera LA, Montuoro R, Lucchese RR, Bevan JW, Suenram RD. Microwave-based structure and four-dimensional morphed intermolecular potential for HI-CO(2). The Journal of Physical Chemistry. A. 111: 11976-85. PMID 17983208 DOI: 10.1021/Jp0744275 |
0.558 |
|
2007 |
Rivera-Rivera LA, McElmurry BA, Belov SP, Lucchese RR, Bevan JW. A three-dimensional morphed potential of Ne-HCl including the ground state deuterated Σ bending vibration Chemical Physics Letters. 444: 9-16. DOI: 10.1016/J.Cplett.2007.06.120 |
0.618 |
|
2006 |
Rivera-Rivera LA, Lucchese RR, Bevan JW. A morphed intermolecular bending potential of OC-HCl Chemical Physics Letters. 429: 68-76. DOI: 10.1016/J.Cplett.2006.08.033 |
0.567 |
|
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