6053 - 6058 |
Theoretical investigation of excited states of oligothiophene anions Alkan F, Salzner U |
6059 - 6065 |
State-to-state dynamics analysis of the F+CHD3 reaction: A Quasiclassical trajectory study Espinosa-Garcia J, Bravo JL |
6066 - 6073 |
Gas phase reactions between acetylene radical cation and water. energies, structures and formation mechanism of C2H3O+ and C2H4O+center dot ions Momoh PO, Xie E, Abrash SA, Meot-Ner M, El-Shall MS |
6074 - 6078 |
Why does argon bind to deuterium? Isotope effects and structures of Ar center dot H5O2+ complexes McCunn LR, Roscioli JR, Elliott BM, Johnson MA, Mccoy AB |
6079 - 6089 |
On the use of different potential energy functions in rare-gas cluster optimization by genetic algorithms: Application to argon clusters Marques JMC, Pereira FB, Leitao T |
6090 - 6097 |
Unimolecular elimination of HF and HCl from chemically activated CF3CFClCH2Cl Zaluzhna O, Simmons JG, Heard GL, Setser DW, Holmes BE |
6098 - 6103 |
Activation parameters for the recombination reaction of intramolecular radical pairs generated from the radical diffusion-inhibited HABI derivative Hatano S, Abe J |
6104 - 6114 |
Ratiometric, fluorescent BODIPY dye with aza crown ether functionality: Synthesis, solvatochromism, and metal ion complex formation Qin WW, Baruah M, Sliwa M, Van der Auweraer M, De Borggraeve WM, Beljonne D, Van Averbeke B, Boens N |
6115 - 6119 |
Reassignment of the vibrational spectrum of benzimidazole Tomkinson J |
6120 - 6124 |
Shock-tube study of the thermal decomposition of CH3CHO and CH3CHO+Hreaction Bentz T, Striebel F, Olzmann M |
6125 - 6133 |
Ab initio molecular dynamics simulation of a medium-sized water cluster anion: From an interior to a surface-located excess electron via a delocalized state Frigato T, VandeVondele J, Schmidt B, Schutte C, Jungwirth P |
6134 - 6149 |
Simple quantitative structure-property relationship (QSPR) Modeling of O-17 carbonyl chemical shifts in substituted benzaldehydes compared to DFT and empirical approaches Kiralj R, Ferreira MAC |
6150 - 6158 |
Hydrogen-bonding interactions in cinchonidine-2-methyl-2-hexenoic acid complexes: A combined spectroscopic and theoretical study Meier DM, Urakawa A, Turra N, Ruegger H, Baiker A |
6159 - 6170 |
Electronic structure of the water dimer cation Pieniazek PA, VandeVondele J, Jungwirth P, Krylov AI, Bradforth SE |
6171 - 6178 |
Influence of structure on electron correlation effects and electron-water dispersion interactions in anionic water clusters Williams CF, Herbert JM |
6179 - 6189 |
Contributions of the 8-methyl group to the vibrational normal modes of flavin mononucleotide and its 5-methyl semiquinone radical Eisenberg AS, Schelvis JPM |
6190 - 6197 |
Formation of C7H7+ from benzyl chloride and chlorotoluene molecular ions: A theoretical study Choe JC |
6198 - 6204 |
Gaussian-3 study of the thermochemistry of the germane and its fluoro chloro derivatives Duchowicz PR, Cobos CJ |
6205 - 6210 |
Nature of the ferromagnetic behavior and possible occurrence of the ferrimagnetic phase transition in genuinely organic molecule-based assemblages with an S=1 and S=1/2 antiferromagnetic alternating spin chain: A Green's function approach Fu HH, Yao KL, Liu ZL |
6211 - 6216 |
Preparation and properties of trifluorothioacetic acid-S-(trifluoromethyl)ester, CF3C(O)SCF3 Ulic SE, Della Vedova CO, Hermann A, Mack HG, Oberhammer H |
6217 - 6226 |
Electron attachment to the hydrogenated Watson-Crick guanine cytosine base pair (GC+H): Conventional and proton-transferred structures Zhang JD, Chen ZF, Schaefer HF |
6227 - 6234 |
Bifurcate hydrogen bonds interaction of intramolecularly H-bonded systems with Lewis bases Sidorkin VF, Doronina EP, Chipanina NN, Aksamentova TN, Shainyan BA |
6235 - 6235 |
Oligothiophene dendrimers as new building blocks for optical applications (vol 112, pg 2018, 2008) Ramakrishna G, Bhaskar A, Bauerle P, Ma CQ, Goodson TG |