검색결과 : 29건
| No. | Article |
|---|---|
| 1 |
From Incident Light to Persistent and Regenerable Radicals of Urea-Assembled Benzophenone Frameworks: A Structural Investigation Goodlett DW, Sindt AJ, Hossain MS, Merugu R, Smith MD, Garashchuk S, Gudmundsdottir AD, Shimizu LS Journal of Physical Chemistry A, 125(6), 1336, 2021 |
| 2 |
Multidimensional Tunneling Dynamics Employing Quantum-Trajectory Guided Adaptable Gaussian Bases Dutra M, Wickramasinghe S, Garashchuk S Journal of Physical Chemistry A, 124(44), 9314, 2020 |
| 3 |
Confinement-Driven Photophysics in Cages, Covalent-Organic Frameworks, Metal-Organic Frameworks, and DNA Dolgopolova EA, Berseneva AA, Faillace MS, Ejegbavwo OA, Leith GA, Choi SW, Gregory HN, Rice AM, Smith MD, Chruszcz M, Garashchuk S, Mythreye K, Shustova NB Journal of the American Chemical Society, 142(10), 4769, 2020 |
| 4 |
Connecting Wires: Photoinduced Electronic Structure Modulation in Metal-Organic Frameworks Dolgopolova EA, Galitskiy VA, Martin CR, Gregory HN, Yarbrough BJ, Rice AM, Berseneva AA, Elegbavwo OA, Stephenson KS, Kittikhunnatham P, Karakalos SG, Smith MD, Greytak AB, Garashchuk S, Shustova NB Journal of the American Chemical Society, 141(13), 5350, 2019 |
| 5 |
Selectively Deuterated Poly(epsilon-caprolactone)s: Synthesis and Isotope Effects on the Crystal Structures and Properties Chang D, Li TY, Li LW, Jakowski J, Huang JS, Keum JK, Lee B, Bonnesen PV, Zhou M, Garashchuk S, Sumpter BG, Hong KL Macromolecules, 51(22), 9393, 2018 |
| 6 |
Nuclear quantum effects on adsorption of H-2 and isotopologues on metal ions Savchenko I, Gu B, Heine T, Jakowski J, Garashchuk S Chemical Physics Letters, 670, 64, 2017 |
| 7 |
The effect of local substrate motion on quantum hydrogen transfer in soybean lipoxygenase-1 modeled with QTES-DFTB dynamics Mazzuca JW, Garashchuk S, Jakowski J Chemical Physics Letters, 613, 104, 2014 |
| 8 |
Analytical potential energy surface for O + C2H2 system Garashchuk S, Rassolov VA, Braams BJ Chemical Physics Letters, 588, 22, 2013 |
| 9 |
Description of proton transfer in soybean lipoxygenase-1 employing approximate quantum trajectory dynamics Mazzuca J, Garashchuk S, Jakowski J Chemical Physics Letters, 542, 153, 2012 |
| 10 |
Calculation of reaction rate constants using approximate evolution of quantum trajectories in imaginary and real time Garashchuk S Chemical Physics Letters, 491(1-3), 96, 2010 |