| 1 |
Molecular dynamics simulation of two photon-absorbing polyimides: Evidence for the formation of intra- and inter-chain dimers
Trohalaki S, Kedziora GS, Pachter R
Polymer, 53(16), 3421, 2012 |
| 2 |
Scalar relativistic effects on energies of molecules containing atoms from hydrogen through argon
Kedziora GS, Pople JA, Ratner MA, Redfern PC, Curtiss LA
Journal of Chemical Physics, 115(2), 718, 2001 |
| 3 |
On comparison of experimental thermochemical data with G3 theory
Curtiss LA, Raghavachari K, Redfern PC, Kedziora GS, Pople JA
Journal of Physical Chemistry A, 105(1), 227, 2001 |
| 4 |
The relativistic Dirac-Coulomb-Fock effect on atomization energies
Kedziora GS, Pople JA, Rassolov VA, Ratner MA, Redfern PC, Curtiss LA
Journal of Chemical Physics, 110(15), 7123, 1999 |
| 5 |
Calculation and Fitting of Potential-Energy and Dipole-Moment Surfaces for the Water Molecule - Fully Ab-Initio Determination of Vibrational Transition Energies and Band Intensities
Kedziora GS, Shavitt I
Journal of Chemical Physics, 106(21), 8733, 1997 |
