Publications

Research articles and reviews:

[110] Weck P. F., Kim E., "Uncloaking the thermodynamics of the studtite to metastudtite shear-induced transformation", J. Phys. Chem. C XXX, XXX (2016).

[109] Weck P. F., Kim E., Wang Y. F. "Van der Waals forces and confinement in carbon nanopores: interaction between CH₄, COOH, NH₃, OH, SH and single-walled carbon nanotubes", Chem. Phys. Lett. 652, 22 (2016).

[108] Sedlacek J. A., Kim E., Rittenhouse S. T., Weck P. F., Sadeghpour H. R., Shaffer J. P., "Electric field cancellation on quartz by Rb adsorbate-induced negative electron affinity", Phys. Rev. Lett. 116, 133201 (2016).

[107] Riddle C., Czerwinski K. R., Kim E., Paviet P., Weck P. F., Poineau F., Conradson S. D., "Characterization of pentavalent and hexavalent americium complexes in nitric acid using X-ray absorption fine structure spectroscopy and first-principles modeling", Radiochim. Acta , (2016).

[106] Rodriguez M. A., Weck P. F., Sugar J. D., Kulp T. J., "Powder X-ray diffraction of metastudtite, (UO₂)O₂(H₂O)₂", Powder Diffraction 31, 71 (2016).

[105] Weck P. F., Kim E., Tikare V., Mitchell J. A., "Mechanical properties of zirconium alloys and zirconium hydrides predicted from density functional perturbation theory", Dalton Trans. 44, 18769 (2015) [cover page].

[104] Johnson T. J., Sweet L. E., Meier D. E., Mausolf E. J., Kim E., Weck P. F., Buck E. C., McNamara B. K., "Time-Resolved Infrared Reflectance Studies of the Dehydration-Induced Transformation of Uranyl Nitrate Hexahydrate to the Trihydrate Form", J. Phys. Chem. A 119, 9996 (2015).

[103] Weck P. F., Kim E., Buck E. C., "On the mechanical stability of uranyl peroxide hydrates: Implications for nuclear fuel degradation", RSC Advances 5, 79090 (2015).

[102] Champion C., Quinto M. A., Monti J. M., Galassi M. E., Weck P. F., Fojon O. A., Hanssen J., Rivarola R. D., "Water versus DNA: new insights into proton track-structure modeling in radiobiology and radiotherapy", Phys. Med. Biol. 60, 7805 (2015) [selected as "Featured Article"].

[101] Weck P. F., Kim E., "Thermodynamics of Technetium: Reconciling Theory and Experiment Using Density Functional Perturbation Analysis", Dalton Trans. 44, 12735 (2015).

[100] Johnson T. J., Sweet L. E., Meier D. E., Mausolf E. J., Kim E., Weck P. F., Buck E. C., McNamara B. K., "Dehydration of Uranyl Nitrate Hexahydrate to the Trihydrate under Ambient Conditions as Observed via Dynamic Infrared Reflectance Spectroscopy", Proc. SPIE 9455, 945504 (2015).

[99] Weck P. F., Kim E., Biedermann G. W., "Interaction of Cesium Adatoms with Free-Standing Graphene and Graphene-Veiled SiO₂ Surfaces", RSC Advances 5, 38623 (2015).

[98] Fromm M., Quinto M. A., Weck P. F., Champion C., "Low energy electrons and swift ion track structure in PADC", Rad. Phys. Chem. 115, 36 (2015).

[97] Champion C., Quinto M. A., Weck P. F., "Electron- and proton-induced ionization of pyrimidine", Eur. Phys. J. D 69, 127 (2015).

[96] Weck P. F., Kim E., Jove-Colon C. F., "Relationship Between Crystal Structure and Thermo-Mechanical Properties of Kaolinite Clay: Beyond Standard Density Functional Theory", Dalton Trans. 44, 12550 (2015) [Cover page] [selected as Dalton Transactions "Hot Article"].

[95] Poineau F., German K. E., Burton-Pye B. P., Weck P. F., Kim E., Kriyzhovets O., Safonov A., Ilin V., Francesconi L. C., Sattelberger A. P., Czerwinski K. R.,"Speciation of Technetium Peroxo Complexes in Sulfuric Acid Revisited", J. Rad. Nucl. Chem. 303, 1163 (2015).

[94] Quinto M. A., Monti J. M., Galassi M. E., Weck P. F., Fojón O. A., Hanssen J., Rivarola R. D., Champion C., "Proton track structure code in biological matter",J. Phys: Conf. Ser. 583, 012049 (2015).

[93] Weck P. F., Kim E., "Layered uranium(VI) hydroxides: structural and thermodynamic properties of dehydrated schoepite α-UO₂(OH)₂", Dalton Trans. 43, 17191 (2014).

[92] Kim E., Mohrland A., Weck P. F., Pang T., Czerwinski K., Tománek D., "Magic numbers in small iron clusters: a first-principles study", Chem. Phys. Lett. 613, 59 (2014) [selected as "Editor's Choice"].

[91] Kothapalli K., Kim E., Kolodziej T., Weck P. F., Alp E. A., Xiao Y., Chow P., Kenney-Benson C., Meng Y., Tkachev S., Kozlowski A., Lavina B., Zhao Y.,"Nuclear forward scattering and first-principles studies of novel iron-oxide phase Fe₄O₅", Phys. Rev. B 90, 024430 (2014).

[90] Champion C., Quinto M. A., Bug M., Baek W. Y., Weck P. F., "Theoretical and experimental quantification of doubly and singly differential cross sections for electron-induced ionization of isolated tetrahydrofuran molecules", Eur. Phys. J. D 68, 205 (2014).

[89] Weck P. F., Kim E., "Solar Energy Storage in Phase Change Materials: First-Principles Thermodynamic Modeling of Magnesium Chloride Hydrates", J. Phys. Chem. C 118, 4618 (2014).

[88] Weck P. F., Kim E., Jove-Colon C. F., Sassani D. C., "First-Principles Study of Anhydrite, Polyhalite and Carnallite", Chem. Phys. Lett. 594, 1 (2014) [Cover page].

[87] Kim E., Weck P. F., Taylor C. D., Olatunji-Ojo O., Liu X.-Y., Mausolf E., Jarvinen G., Czerwinski K. R., "First-principles and kinetic Monte Carlo simulation studies of the reactivity of Tc(0001), MoTc(111) and MoTc(110) surfaces", J. Electrochem. Soc. 161, C83 (2014).

[86] Champion C., Galassi M. E., Weck P. F., Abdallah C., Francis Z., Quinto M. A., Fojón O. A., Rivarola R. D., Hanssen J., Iriki Y., Itho A., "Ionization induced by protons on isolated molecules of adenine: theory, modelling and experiment", J. Phys: Conf. Ser. 488, 012038 (2014).

[85] Malliakas C. D., Poineau F., Johnstone E. V., Weck P. F., Kim E., Scott B. L., Forster P. M., Kanatzidis M. G., Czerwinski K. R., Sattelberger A. P., "β-Technetium Dichloride: Solid-State Modulated Structure, Electronic Structure and Physical Properties", J. Am. Chem. Soc. 135, 15955 (2013).

[84] Weck P. F., Kim E., Czerwinski K. R., "Semiconducting Layered Technetium Dichalcogenides: Insights from First-Principles", Dalton Trans. 42, 15288 (2013) [Cover Page][selected as Dalton Transactions "Hot Article"].

[83] Agnihotri A. N., Kasthurirangan S., Nandi S., Kumar A., Galassi M. E., Rivarola R. D., Fojón O. A., Champion C., Hanssen J., Lekadir H., Weck P. F., Tribedi L. C., "Absolute total ionization cross sections of uracil (C₄H₄N₂O₂) in collisions with MeV energy highly charged carbon and oxygen and fluorine ions", J. Phys. B 46, 185201 (2013).

[82] Champion C., Galassi M. E., Weck P. F., Incerti S., Rivarola R. D., Fojón O. A., Hanssen J., Iriki Y., Itho A., "Proton-induced ionization of isolated uracil molecules: A theory/experiment confrontation", Nucl. Instr. Meth. B 314, 66 (2013).

[81] Poineau F., Weck P. F., Burton-Pye B. P., Kim E., Francesconi L. C., Sattelberger A. P., German K. E., Czerwinski K. R., "Diperoxo Pertechnetic Acid Revealed by Spectroscopic and Quantum Chemical Studies", Eur. J. Inorg. Chem. 26, 4595 (2013).

[80] Safavi-Naini A., Kim E., Weck P. F., Rabl P., Sadeghpour H. R., "Influence of monolayer contamination on electric-field-noise heating in ion traps", Phys. Rev. A 87, 023421 (2013).

[79] Poineau F., Weck P. F., Burton-Pye B. P., Denden I., Kim E., Kerlin W., German K. E., Fattahi M., Francesconi L. C., Sattelberger A. P., Czerwinski K. R.,"Reactivity of pertechnetic acid with methanol in sulfuric acid: technetium sulfates complexes revealed by X-ray absorption spectroscopy and first-principles calculations", Dalton Trans. 42 (Communication), 4348 (2013).

[78] Weck P. F., Kim E., Jove-Colon C. F., Sassani D. C., "On the role of strong electron correlations in the surface properties and chemistry of uranium dioxide",Dalton Trans. 42, 4570 (2013).

[77] Bhattacharyya A., Kim E., Weck P. F., Forster P. M., Czerwinski K. R., "Trivalent actinide and lanthanide complexation of 5,6-Dialkyl-2,6-Bis-(1,2,4-triazin-3-yl)pyridine (RBTP; R=H, Me, Et) derivatives: a combined experimental and first-principles study", Inorg. Chem. 52, 761 (2013).

[76] Johnstone E. V., Weck P. F., Poineau F., Kim E., Forster P. M., Sattelberger A. P., Czerwinski K. R., "X-Ray crystallographic and first-principles theoretical studies of K₂TcOCl₅ and UV-Visible investigation of the [TcOCl₅]^2- and [TcOCl₄]^- ions", Eur. J. Inorg. Chem. (Communication) 2013, 1097 (2013).

[75] Weck P. F., "Worker exposure for at-reactor management of spent nuclear fuel", Radiat. Prot. Dosimetry 156, 386 (2013).

[74] Sassani D. C., Jove-Colon C. F., Weck P. F., "Integrating used fuel degradation models into generic performance assessment", Am. Nucl. Soc. Proc. 2, 671-678 (2013). 14th International High-Level Radioactive Waste Management Conference: Integrating Storage, Transportation, and Disposal, IHLRWMC 2013; Albuquerque, NM; United States; 28 April 2013 through 2 May 2013; Code 100207. ISBN: 978-162748644-6

[73] Weck P. F., Kim E., Jove-Colon C. F., Sassani D. C., "Spent nuclear fuel and its corrosion products: a quantum-mechanical modeling investigation", Am. Nucl. Soc. Proc. 1, 419-424 (2013). 14th International High-Level Radioactive Waste Management Conference: Integrating Storage, Transportation, and Disposal, IHLRWMC 2013; Albuquerque, NM; United States; 28 April 2013 through 2 May 2013; Code 100207. ISBN: 978-162748644-6

[72] Weck P. F., Kim E., Jove-Colon C. F., Sassani D. C., "Structures of uranyl peroxide hydrates: a first-principles study of studtite and metastudtite", Dalton Trans. 41, 9748 (2012).

[71] Champion C., Galassi M. E., Fojón O. A., Lekadir H., Hanssen J., Rivarola R. D., Weck P. F., Agnihotri A. N., Nandi S., Tribedi L. C., "Ionization of RNA-uracil by highly charged carbon ions", J. Phys.: Conf. Ser. 373, 012004 (2012).

[70] Poineau F., Johnstone E., Weck P. F., Forster P., Kim E., Czerwinski K. R., Sattelberger A. P., "β-technetium trichloride: formation, structure and first-principles calculations", Inorg. Chem. 51 (Communication), 4915 (2012).

[69] Champion C., Weck P. F., Lekadir H., Galassi M. E., Fojón O. A., Abufager P., Rivarola R. D., Hanssen J., "Proton-induced single electron capture on DNA/RNA bases", Phys. Med. Biol. 57, 3039 (2012).

[68] Ferrier M., Weck P. F., Poineau F., Kim E., Stebbins A., Ma L., Sattelberger A. P., Czerwinski K. R., "First evidence for the formation of technetium oxosulfide complexes: synthesis, structure and characterization", Dalton Trans. 41, 6291 (2012).

[67] Galassi M. E., Champion C., Weck P. F., Rivarola R. D., Fojón O., Hanssen J., "Quantum mechanical predictions of DNA and RNA bases ionization by energetic proton beams", Phys. Med. Biol. 57, 2081 (2012).

[66] Poineau F., Johnstone E., Weck P. F., Kim E., Conradson S. D., Sattelberger A. P., Czerwinski K. R., "On the structure of β-molybdenum dichloride", Inorg. Chem. 51, 4965 (2012).

[65] Agnihotri A. N., Kasthurirangan S., Nandi S., Kumar A., Galassi M. E., Rivarola R. D., Fojón O., Champion C., Hanssen J., Lekadir H., Weck P. F., Tribedi L. C.,"Ionization of uracil in collisions with highly charged carbon and oxygen ions of energy 100 keV to 78 MeV", Phys. Rev. A 85, 032711 (2012).

[64] Silva G. W. C., Yeamans C. B., Weck P. F., Hunn J. D., Cerefice G. S., Sattelberger A. P., Czerwinski K. R., "Synthesis and characterization of Th₂N₂(NH) isomorphous to Th₂N₃", Inorg. Chem. 51, 3332 (2012).

[63] Silva G. W. C., Weck P. F., Kim E., Yeamans C. B., Cerefice G. S., Sattelberger A. P., Czerwinski K. R., "Crystal and electronic structures of neptunium nitrides synthesized using a fluoride route", J. Am. Chem. Soc. 134, 3111 (2012).

[62] Champion C., Galassi M. E., Weck P. F., Fojón O. A., Hanssen J., Rivarola, R. D., "Quantum-mechanical contributions to numerical simulations of charged particle transport at the DNA scale", in Radiation damage in biomolecular systems, Garcia Gomez-Tejedor G. G. and Fuss M. C., eds.; Springer (2012), Chapt. 16, p. 263.

[61] Lavina B., Dera P., Kim E., Meng Y., Downs R. T., Weck P. F., Sutton S. R., Zhao Y., "Discovery of the recoverable high-pressure iron oxide Fe₄O₅", Proc. Natl. Acad. Sci. USA 108, 17281 (2011).

[60] Safavi-Naini A., Rabl P., Weck P. F., Sadeghpour H. R., "Microscopic model of electronic-field-noise heating in ion traps", Phys. Rev. A 84, 023412 (2011) [selected for a Viewpoint in APS Physics].

[59] Weck P. F., Kim E., Czerwinski K. R., "Interplay between structure, stoichiometry and properties of technetium nitrides", Dalton Trans. 40, 6738 (2011) [selected as Dalton Transactions "Hot Article"].

[58] Poineau F., Malliakas C. D., Weck P. F., Scott B. L., Johnstone E. V., Forster P. M., Kim E., Kanatzidis M. G., Czerwinski K. R., Sattelberger A. P., "Technetium dichloride: a new binary halide containing metal-metal multiple bonds", J. Am. Chem. Soc. 133 (Communication), 8814 (2011).

[57] Weck P. F., Gong C.-M. S., Kim E., Thuery P., Czerwinski K. R., "One-dimensional uranium-organic coordination polymers: crystal and electronic structures of uranyl-diacetohydroxamate", Dalton Trans. 40, 6007 (2011).

[56] Hartmann T., Alaniz A., Poineau F., Weck P. F., Valdez J. A., Tang M., Jarvinen G. D., Czerwinski K. R., Sickafus K. E., "Structure studies on lanthanide technetium pyrochlores as prospective host phases to immobilize ⁹⁹technetium and fission lanthanides from effluents of reprocessed used nuclear fuels", J. Nucl. Mater. 411, 60 (2011).

[55] Weck P. F., Sergeeva A. P., Kim E., Boldyrev A. I., Czerwinski K. R., "Chemical bonding and aromaticity in trinuclear transition-metal halide clusters", Inorg. Chem. 50, 1039 (2011).

[54] Chang K., Kim E., Weck P. F., Tománek D., "Nanoconfinement effects on the reversibility of hydrogen storage in ammonia borane: a first-principles study", J. Chem. Phys. 134, 214501 (2011). [June 7, 2011 Cover Page]. (Top 20 most downloaded paper from the June 2011 volume of J. Chem. Phys.)

[53] Poineau F., Johnstone E., Weck P. F., Kim E., Forster P., Scott B., Sattelberger A. P., Czerwinski K. R., "Synthesis and structure of technetium trichloride", J. Am. Chem. Soc. 132 (Communication), 15864 (2010).

[52] Poineau F., Weck P. F., German K., Maruk A., Kirakosyan G., Lukens W. W., Rego D. B., Sattelberger A. P., Czerwinski K. R., "Speciation of heptavalent technetium in sulfuric acid: structural and spectroscopic studies", Dalton Trans. 39 (Communication), 8616 (2010).

[51] Warburton J., Weck P. F., Smith N., Czerwinski K. R., "Use of UV-visible spectroscopy to determine solution chemistry under used nuclear fuel reprocessing conditions", J. Nucl. Mater. Manag. 39, 26 (2010).

[50] Weck P. F., Kim E., Poineau F., Rodriguez E. E., Sattelberger A. P., Czerwinski K. R., "Structural and electronic trends in rare-earth technetate pyrochlores",Dalton Trans. 39 (Communication), 7207 (2010) [selected as Dalton Transactions "Hot Article"].

[49] Weck P. F., Kim E., Czerwinski K. R., Tománek D., "Structural and magnetic properties of Tc_n@C₆₀ endohedral metalofullerenes: first-principles predictions",Phys. Rev. B 81, 125448 (2010).

[48] Pravica M., Galley M., Kim E., Weck P. F., Liu Z., "A far- and mid-infrared study of HMX (octahydro-1,3,5,7-tetranitro-1,3,5,7-tetrazocine) under high pressure", Chem. Phys. Lett. 500, 28 (2010).

[47] Poineau F., Hartmann T., Weck P. F., Kim E., Silva G. W. C., Jarvinen G., Czerwinski K. R., "Structural studies of technetium-zirconium alloys by X-ray diffraction, high-resolution electron microscopy, and first-principles calculations", Inorg. Chem. 49, 1433 (2010).

[46] Weck P. F., Kim E., Masci B., Thuery P., Czerwinski K. R., "Density functional analysis of the trigonal uranyl equatorial coordination in hexahomotrioxacalix[3]arene-based macrocyclic complexes", Inorg. Chem. 49, 1465 (2010).

[45] Weck P. F., Kim E., Czerwinski K. R., "First-principles study of the hexahalogenotechnetate(IV) ions [TcX₆]^2- [X = Cl, Br]", Chem. Phys. Lett. 487, 190 (2010).

[44] Poineau F., Weck P. F., Forster P., Sattelberger A. P., Czerwinski K. R., "Synthesis, structure, and first-principles calculations of the TcBr₂(PMe₃)₄ and Tc₂Br₄(PMe₃)₄ complexes", Dalton Trans., 10338 (2009).

[43] Weck P. F., Kim E., Poineau F., Czerwinski K. R., "Structural evolution and properties of subnanometer Tc_n (n = 2-15) clusters", Phys. Chem. Chem. Phys.11, 10003 (2009).

[42] Weck P. F., Kim E., Poineau F., Rodriguez E., Sattelberger A. P., Czerwinski K. R., "Technetium(IV) halides predicted from first-principles", Inorg. Chem. 48, 6555 (2009).

[41] Poineau F., Rodriguez E. E., Weck P. F., Sattelberger A. P., Forster P., Hartmann T., Mausolf E., Silva G. W. C., Jarvinen G. D., Cheetham A. K., Czerwinski K. R., "Review of technetium chemistry research conducted at the University of Nevada Las Vegas", J. Rad. Nucl. Chem. 282, 605 (2009).

[40] Tkachev S., Pravica M., Kim E., Weck P. F., "Raman spectroscopic study of cyclopentane at high pressure", J. Chem. Phys. 130, 204505 (2009).

[39] Hosseini B. H., Weck P. F., Sadeghpour H. R., Kirby K. P., Stancil P. C., "Photodissociation dynamics of lithium chloride: contribution of interferometric predissociation", J. Chem. Phys. 130, 054308 (2009).

[38] Weck P. F., Gobin C., Kim E., Pravica M., "Organic cyclic difluoramino-nitramines: infrared and Raman spectroscopy of 3,3,7,7-tetrakis(difluoramino)octahydro 1,5-dinitro-1,5-diazocine (HNFX)", J. Raman Spectro. 40, 964 (2009).

[37] Tkachev S., Pravica M., Kim E., Romano E., Weck P. F., "High pressure studies of 1,3,5,7-cyclooctatetraene: experiment and theory", J. Phys. Chem. A 112, 11501 (2008).

[36] Kim E., Weck P. F., Berber S., Tománek D., "Mechanism of fullerene hydrogenation by polyamines: ab initio density functional calculations", Phys. Rev. B 78, 113404 (2008).

[35] Weck P. F., Kim E., Lepp S. H., Balakrishnan N., Sadeghpour H. R., "Dimer-induced stabilization of H adsorbate cluster on BN(0001) surface", Phys. Chem. Chem. Phys. 10 (Communication), 5184 (2008). [September 14, 2008 Cover Page].

[34] Miller G., Kintigh J., Kim E., Weck P. F., Berber S., Tománek D., "Hydrogenation of single-wall carbon nanotubes using polyamine reagents: combined experimental and theoretical study", J. Am. Chem. Soc. 130, 2296 (2008).

[33] Kim E., Weck P. F., Balakrishnan N., Bae C., "Nanoscale building blocks for the development of novel proton-exchange membrane fuel cells", J. Phys. Chem. B 112 (Letter), 3283 (2008). [March 20, 2008 Cover Page].

[32] Kim E., Kumar R., Weck P. F., Cornelius A. L., Nicol M., Vogel S. C., Zhang J., Hartl M., Stowe A., Daemen L., Zhao Y., "Pressure-driven phase transitions in NaBH4: theory and experiments", J. Phys. Chem. B 111 (Letter), 138773 (2007).

[31] Weck P. F., Kim E., Balakrishnan N., Poineau F., Yeamans C. B., Czerwinski K. R., "First-principles study of single-crystal uranium mono- and dinitride",Chem. Phys. Lett. 443, 82 (2007).

[30] Kumar T. J. D., Weck P. F., Balakrishnan N., "Evolution of small Ti clusters and the dissociative chemisorption of H₂ on Ti", J. Phys. Chem. C 111, 7494 (2007).

[29] Weck P. F., Kim E., Balakrishnan N., Cheng H., Yakobson B. I., "Designing carbon nanoframeworks tailored for hydrogen storage", Chem. Phys. Lett. 439, 354 (2007). (Ranked 5th in Top 25 Hottest Articles of Chem. Phys. Lett. for April-June 2007)

[28] Weck P. F., Kumar T. J. D., Kim E., Balakrishnan N., "Computational study of hydrogen storage in organometallic compounds", J. Chem. Phys. 126, 094703 (2007). (Top 20 most downloaded paper from the March 2007 volume of J. Chem. Phys.)

[27] Weck P. F., "Double ionization of molecular hydrogen by fast electron impact", Commun. Comput. Phys. 2, 466 (2007).

[26] Weck P. F., Balakrishnan N., "Importance of long-range interactions in chemical reactions at cold and ultracold temperatures", Int. Rev. Phys. Chem. 25, 283 (2006). (#4 most downloaded paper from the 2006 volume of Int. Rev. Phys. Chem.)

[25] Weck P. F., Stancil P. C., Kirby K. P., Schweitzer A., Hauschildt P. H., "Metal hydride and alkali halide opacities in extrasolar giant planets and cool stellar atmospheres", NASA/CP-2006-214549, 274 (2006).

[24] Weck P. F., Balakrishnan N., "Dynamics of chemical reactions at cold and ultracold temperatures", J. Phys. B 39, S1215 (2006).

[23] Weck P. F., Balakrishnan N., Brandao J., Rosa C., Wang W., "Dynamics of the O(³P)+H₂ reaction at low temperatures: comparison of quasiclassical trajectory with quantum scattering calculations", J. Chem. Phys. 124, 074308 (2006).

[22] Weck P. F., Balakrishnan N., "Reactivity enhancement of ultracold O(³P)+H₂ collisions by van der Waals interactions", J. Chem. Phys. 123, 144307 (2005).

[21] Weck P. F., Balakrishnan N., "Heavy atom tunneling in chemical reactions: study of H+LiF collisions", J. Chem. Phys. 122, 234310 (2005).

[20] Weck P. F., Balakrishnan N., "Quantum dynamics of the Li+HF→H+LiF reaction at ultralow temperatures", J. Chem. Phys. 122, 154309 (2005).

[19] Homeier D., Allard N. F., Allard F., Hauschildt P. H., Schweitzer A., Stancil P. C., Weck P. F., "Modelling alkali line absorption and molecular bands in cool DAZs", Astronomical Society of the Pacific Conf. Series 334, 209 (2005).

[18] Weck P. F., Balakrishnan N., "Chemical reactivity of ultracold polar molecules: investigation of H+HCl and H+DCl collisions", Eur. Phys. J. D 31, 417 (2004).

[17] Ghigo G., Roos B. O., Stancil P. C., Weck P. F., "A theoretical study of the excited states of CrH: potential energies, transition moments, and lifetimes", J. Chem. Phys. 121, 8194 (2004).

[16] Weck P. F., Schweitzer A., Kirby K. P., Hauschildt P. H., Stancil P. C., "Molecular line opacity of LiCl in the mid-infrared spectra of brown dwarfs", Astrophys. J. 613, 567 (2004).

[15] Weck P. F., Kirby K. P., Stancil P. C., "Ab initio configuration interaction study of the low-lying ¹Σ⁺ electronic states of LiCl", J. Chem. Phys. 120, 4216 (2004).

[14] Stia C. R., Fojón O. A., Weck P. F., Hanssen J., Rivarola R. D., "Interference effects in single ionization of molecular hydrogen by electron impact", J. Phys. B.36, L257 (2003).

[13] Skory S., Weck P. F., Stancil P. C., Kirby K. P., "New theoretical line list for the B'-X system of MgH", Astrophys. J., Supp. Ser. 148, 599 (2003).

[12] Weck P. F., Stancil P. C., Kirby K. P., "Theoretical study of the rovibrationally resolved transitions of CaH", J. Chem. Phys. 118, 9997 (2003).

[11] Weck P. F., Schweitzer A., Stancil P. C., Hauschildt P. H., Kirby K. P., "The molecular continuum opacity of MgH in cool stellar atmospheres", Astrophys. J.584, 459 (2003).

[10] Weck P. F., Schweitzer A., Stancil P. C., Hauschildt P. H., Kirby K. P., "The molecular line opacity of MgH in cool stellar atmospheres", Astrophys. J. 582, 1263 (2003).

[9] Weck P. F., Stancil P. C., Kirby K. P., "B'-X rovibrationally-resolved photodissociation of MgH", Astrophys. J. 582, 1059 (2003).

[8] Fojón O. A., Stia C. R., Weck P. F., Hanssen J., Joulakian B., Rivarola R. D., "Ionization of molecular hydrogen by electron impact", Inst. Phys. Conf. Ser. 177, 11 (2003).

[7] Weck P. F., Schweitzer A., Stancil P. C., Hauschildt P. H., Kirby K. P., Yamaguchi Y., Allen W. D., "Molecular line and continuum opacities for modeling of Extrasolar Giant Planet and cool stellar atmospheres", NASA/CP-2002-21186, 165 (2002).

[6] Stia C., Fojón O. A., Weck P. F., Hanssen J., Joulakian B., Rivarola R. D., "Molecular three-continuum approximation for ionization of H₂ by electron impact",Phys. Rev. A 66, 052709 (2002).

[5] Weck P. F., Fojón O. A., Joulakian B., Stia C., Hanssen J., Rivarola R. D., "Two-center continuum approximation with correct boundary condition for single electron emission in e+H₂ collisions", Phys. Rev. A 66, 012711 (2002).

[4] Weck P. F., Fojón O. A., Hanssen J., Joulakian B., Rivarola R. D., "Two-effective center approximation for the single ionization of molecular hydrogen by fast electron impact", Phys. Rev. A 63, 042709 (2001).

[3] Joulakian B., Weck P. F., "Vibrational effects in (e,2e) ionization of diatomic targets by fast electron impact", Proc. SPIE 4243, 194 (2001).

[2] Weck P. F., Joulakian B., Hanssen J., Fojón O. A., Rivarola R. D., "Multiple differential cross sections for single ionization of H₂ , D₂ and T₂ molecules by fast electron impact: Influence of vibrational states", Phys. Rev. A 62, 014701 (2000).

[1] Weck P. F., Joulakian B., Hervieux P. A., "Fivefold differential cross section of fast (e,2e) ionization of H₂, D₂ and T₂ by a Franck-Condon approach", Phys. Rev.A 60, 3013 (1999).

Books:

[2] Proceedings of the 2006 NASA Laboratory Astrophysics Workshop, (NASA/CP-2006-214549, Moffett Field, 2006), Weck P. F., Kwong V. H. S., Salama F., Eds.(Available online at NASA STI and 2006 NASA LAW websites.)

[1] Book of Abstracts of the 2006 NASA Laboratory Astrophysics Workshop, (UNLV, Las Vegas, 2006), Weck P. F., Kwong V. H. S., Eds.