| 1 |
Understanding the effect of heteroatoms on structural and electronic properties of conjugated polymers
Bhatta RS, Tsige M
Polymer, 56, 293, 2015 |
| 2 |
Effect of torsional potential on the predicted phase behavior of n-alkanes
Bernard-Brunel DA, Potoff JJ
Fluid Phase Equilibria, 279(2), 100, 2009 |
| 3 |
Vibrational spectra and molecular association of titanium tetraisopropoxide
Moran PD, Bowmaker GA, Cooney RP, Finnie KS, Bartlett JR, Woolfrey JL
Inorganic Chemistry, 37(11), 2741, 1998 |
| 4 |
Eigenstates for Internal Rotors with Angle-Dependent Moment of Inertia
Mellor WE, Kalotas TM, Lee AR
Journal of Chemical Physics, 106(17), 6825, 1997 |
| 5 |
Conformational Information from Vibrational-Spectra of Styrene, Trans-Stilbene, and Cis-Stilbene
Choi CH, Kertesz M
Journal of Physical Chemistry A, 101(20), 3823, 1997 |
| 6 |
Carbon-Carbon Rotational Barriers in Butane, 1-Butene, and 1,3-Butadiene
Murcko MA, Castejon H, Wiberg KB
Journal of Physical Chemistry, 100(40), 16162, 1996 |
| 7 |
Ab-Initio Study of Styrene and Beta-Methyl Styrene in the Ground and in the 2 Lowest Excited Singlet-States
Zilberg S, Haas Y
Journal of Chemical Physics, 103(1), 20, 1995 |
| 8 |
Combining Molecular Mechanics with Quantum Treatments for Large Conjugated Hydrocarbons .2. A Geometry-Dependent Heisenberg Hamiltonian
Treboux G, Maynau D, Malrieu JP
Journal of Physical Chemistry, 99(17), 6417, 1995 |
| 9 |
Molecular Modeling of Poly-Alpha-Olefin Synthetic Oils
Lahtela M, Pakkanen TA, Nissfolk F
Journal of Physical Chemistry, 99(25), 10267, 1995 |
| 10 |
Determinants of the Vinyl Stretching Frequency in Protoporphyrins - Implications for Cofactor-Protein Interactions in Heme-Proteins
Kalsbeck WA, Ghosh A, Pandey RK, Smith KM, Bocian DF
Journal of the American Chemical Society, 117(44), 10959, 1995 |
