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Chet Swalina, Ph.D. - Publications

Affiliations: 
2006 Pennsylvania State University, State College, PA, United States 
Area:
theoretical and computational methods for describing chemical reactions in condensed phases and at interfaces
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13 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2013 Sirjoosingh A, Pak MV, Swalina C, Hammes-Schiffer S. Reduced explicitly correlated Hartree-Fock approach within the nuclear-electronic orbital framework: applications to positronic molecular systems. The Journal of Chemical Physics. 139: 034103. PMID 23883006 DOI: 10.1063/1.4812259  0.717
2013 Sirjoosingh A, Pak MV, Swalina C, Hammes-Schiffer S. Reduced explicitly correlated Hartree-Fock approach within the nuclear-electronic orbital framework: theoretical formulation. The Journal of Chemical Physics. 139: 034102. PMID 23883005 DOI: 10.1063/1.4812257  0.717
2012 Swalina C, Pak MV, Hammes-Schiffer S. Analysis of electron-positron wavefunctions in the nuclear-electronic orbital framework. The Journal of Chemical Physics. 136: 164105. PMID 22559468 DOI: 10.1063/1.4704124  0.741
2011 Ko C, Pak MV, Swalina C, Hammes-Schiffer S. Alternative wavefunction ansatz for including explicit electron-proton correlation in the nuclear-electronic orbital approach. The Journal of Chemical Physics. 135: 054106. PMID 21823689 DOI: 10.1063/1.3611054  0.702
2010 Swalina C, Maroncelli M. Nonradiative deactivation in benzylidene malononitriles Journal of Physical Chemistry C. 114: 5602-5610. DOI: 10.1021/Jp907319N  0.384
2008 Adamson PE, Duan XF, Burggraf LW, Pak MV, Swalina C, Hammes-Schiffer S. Modeling positrons in molecular electronic structure calculations with the nuclear-electronic orbital method. The Journal of Physical Chemistry. A. 112: 1346-51. PMID 18215029 DOI: 10.1021/Jp7098015  0.728
2007 Kumarasiri M, Swalina C, Hammes-Schiffer S. Anharmonic effects in ammonium nitrate and hydroxylammonium nitrate clusters. The Journal of Physical Chemistry. B. 111: 4653-8. PMID 17474693 DOI: 10.1021/Jp065569M  0.667
2007 Swalina C, Wang Q, Chakraborty A, Hammes-Schiffer S. Analysis of nuclear quantum effects on hydrogen bonding. The Journal of Physical Chemistry. A. 111: 2206-12. PMID 17388289 DOI: 10.1021/Jp0682661  0.629
2006 Swalina C, Pak MV, Chakraborty A, Hammes-Schiffer S. Explicit dynamical electron-proton correlation in the nuclear-electronic orbital framework. The Journal of Physical Chemistry. A. 110: 9983-7. PMID 16913669 DOI: 10.1021/Jp0634297  0.782
2005 Swalina C, Hammes-Schiffer S. Impact of nuclear quantum effects on the molecular structure of bihalides and the hydrogen fluoride dimer. The Journal of Physical Chemistry. A. 109: 10410-7. PMID 16833338 DOI: 10.1021/Jp053552I  0.699
2005 Swalina C, Pak MV, Hammes-Schiffer S. Analysis of the nuclear-electronic orbital method for model hydrogen transfer systems. The Journal of Chemical Physics. 123: 014303. PMID 16035831 DOI: 10.1063/1.1940634  0.716
2005 Swalina C, Pak MV, Hammes-Schiffer S. Alternative formulation of many-body perturbation theory for electron-proton correlation Chemical Physics Letters. 404: 394-399. DOI: 10.1016/J.Cplett.2005.01.115  0.665
2004 Pak MV, Swalina C, Webb SP, Hammes-Schiffer S. Application of the nuclear-electronic orbital method to hydrogen transfer systems: Multiple centers and multiconfigurational wavefunctions Chemical Physics. 304: 227-236. DOI: 10.1016/J.Chemphys.2004.06.009  0.726
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