| Thursday, 2 November 2006: 9:00 AM-11:00 AM | |||
| Oglethorpe Ballroom (Augusta Marriott Hotel and Suites) | |||
| Physical Chemistry (20) | |||
| Posters: Physical chemistry (PHYS) | |||
| Organizers: | Ann Visser John T. Reilly Bryan G. Splawn | ||
| 303 | Improving the van der Waals gas equation James H. McNeill, Dermot J. Collins | ||
| 304 | Pentadiene formation during cyclopentene pyrolysis Bansi L. Kalra, David K. Lewis | ||
| 305 | Surface states of titanium dioxide modified with organic compounds Chad E. Ward, Linda De la Garza | ||
| 306 | Theoretical study on kinetics and mechanism for ClOClO2 with Cl/ClO* Zhen F. Xu, M. C. Lin | ||
| 307 | Ab initio study on kinetics and mechanism for C6H5O and CH3* Kun Xu, Zhen F. Xu, M.C. LIN | ||
| 308 | Adsorption and dissociation of H2O on W(111) surface : a computational study Hsin-Tsung Chen, Djamaladdin G. Musaev, Stephan Irle, M.C. Lin | ||
| 309 | Unimolecular decomposition of oxalic acid and formic acid: ab initio mo calculations Jee-Gong Chang, Hsin-Tsung Chen, Shucheng Xu, M.C. LIN | ||
| 310 | Computatioal study on the kinetics and mechanism for the decomposition of succinic acid Jee-Gong Chang, Hsin-Tsung Chen, Shucheng Xu, M.C. LIN | ||
| 311 | Explanation of anomalous electron spin resonance features for isotopomers of the methylamine radical cation Meghan M. Felts, John J. Banisaukas, Lon B. Knight | ||
| 312 | Conformers of gaseous cysteine Maria C. Lind | ||
| 313 | Formation of fulvene from allyl and propargyl radicals Sunghwan Kim, Wesley D. Allen, Henry F. Schaefer III | ||
| 314 | Density and excess volume of ethyl acetate and triethylamine mixtures from 10°C to 46° C Ashley Mack, April McKnight, Tamara Brown, Keisha Enwright, Nasrollah Hamidi | ||
| 315 | Diagnosis of basis set deficiencies that give non-planar arenes and other anomalous structure predictions Andrew C. Simmonett, Wesley D. Allen, Henry F. Schaefer III | ||
| 316 | Multireference coupled cluster theory: derivation of coupling terms and a new implementation of MkCC, BWCC and apBWCC Francesco A. Evangelista, Wesley D. Allen, Henry F. Schaefer | ||
| 317 | Cl-C-SiCl3 isolation and identification of an unusually stable triplet carbene Justin B. Ingels, Wesley D Allen, Henry F Schaefer | ||
| 318 | 31P NMR on ATP-cation interactions Zhiyan Song, Jemeral Eady, Rashanna Sutton, Rasheed Lawal, Artez Sims | ||
| 319 | Resolving heterogeneous and homogeneous mechanisms for nonexponential kinetics using 2D transient grating spectroscopy Champak Khurmi, Emile van Veldhoven, Xinzheng Zhang, Mark A. Berg | ||
| 320 | A computational chemistry study of spin-trap molecules Tande Jacob Fosso, Scott J. Kirkby | ||
| 321 | Bridging the time and frequency domains enables Raman spectroscopy with femtosecond pulses Sean J. Kern, Diana C Urbanek, Sukhendu Nath, Mark A Berg | ||
| 322 | Photodissociation of OClO probed in “hyper-rovibronic” detail Bobby H. Layne, Daphne L. Villanueva, Liam M. Duffy | ||
| 323 | Scanning tunneling microscopy of indolo[2,1-b]quinazolin-6,12-dione (tryptanthrin) on HOPG: evidence of adsorption-induced stereoisomerization Jerry W. Buhrow, Mark J. Novak, J. Clayton Baum, Joel A. Olson | ||
| 324 | Systematic study of the relative energies and barriers for interconversion of XC(O)SH and XC(S)OH isomers (X=F,OH,NH2,CH3,BH2,BeH,Li) D. Allen Clabo | ||
| 325 | Investigation into fullerene-porphyrin complexation via NMR relaxation measurements Art A. Rodriguez, Slava Kliban | ||
| 326 | Computational design of low-dimensional nanomaterials Zhongfang Chen, Zhen Zhou, Jijun Zhao, Paul von Ragué Schleyer | ||
| Part 1 | |||
| 327 | Synthesis and polymerization of diacetylenethiol-functionalized gold nanoparticles William M. Pryor, Mathew Foote, William Gillespie, Timothy W. Hanks | ||
Back to The 58th Southeast Regional Meeting (November 1-4, 2006)