화학공학소재연구정보센터
검색결과 : 8건
No. Article
1 Tribute to Russell M. Pitzer
Shavitt I
Journal of Physical Chemistry A, 113(45), 12339, 2009
2 Does the A center dot T or G center dot C base-pair possess enhanced stability? Quantifying the effects of CH center dot center dot center dot O interactions and secondary interactions on base-pair stability using a phenomenological analysis and ab initio calculations
Quinn JR, Zimmerman SC, Del Bene JE, Shavitt I
Journal of the American Chemical Society, 129(4), 934, 2007
3 Short H-bonds and spontaneous self-dissociation in (H2O)(20): Effects of H-bond topology
Kuo JL, Ciobanu CV, Ojamae L, Shavitt I, Singer SJ
Journal of Chemical Physics, 118(8), 3583, 2003
4 Multi-state Multireference Rayleigh-Schrodinger Perturbation Theory for Mixed Electronic States: Second and Third Order
Shavitt I
International Journal of Molecular Sciences, 3(6), 639, 2002
5 Structure and vibrational spectra of H+(H2O)(8): Is the excess proton in a symmetrical hydrogen bond?
Ciobanu CV, Ojamae L, Shavitt I, Singer SJ
Journal of Chemical Physics, 113(13), 5321, 2000
6 Potential models for simulations of the solvated proton in water
Ojamae L, Shavitt I, Singer SJ
Journal of Chemical Physics, 109(13), 5547, 1998
7 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
8 Boys,Samuel,Francis
Handy NC, Pople JA, Shavitt I
Journal of Physical Chemistry, 100(15), 6007, 1996