화학공학소재연구정보센터
검색결과 : 9건
No. Article
1 Anionic Ring-Opening Polymerization Simulations for Hyperbranched Polyglycerols with Defined Molecular Weights
Paulus F, Weiss MER, Steinhilber D, Nikitin AN, Schutte C, Haag R
Macromolecules, 46(21), 8458, 2013
2 Unwinding of a Skyrmion Lattice by Magnetic Monopoles
Milde P, Kohler D, Seidel J, Eng LM, Bauer A, Chacon A, Kindervater J, Muhlbauer S, Pfleiderer C, Buhrandt S, Schutte C, Rosch A
Science, 340(6136), 1076, 2013
3 Hydrogen Forms in Water by Proton Transfer to a Distorted Electron
Marsalek O, Frigato T, VandeVondele J, Bradforth SE, Schmidt B, Schutte C, Jungwirth P
Journal of Physical Chemistry B, 114(2), 915, 2010
4 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
Journal of Physical Chemistry A, 112(27), 6125, 2008
5 Fully adaptive propagation of the quantum-classical Liouville equation
Horenko I, Weiser M, Schmidt B, Schutte C
Journal of Chemical Physics, 120(19), 8913, 2004
6 Multidimensional classical Liouville dynamics with quantum initial conditions
Horenko I, Schmidt B, Schutte C
Journal of Chemical Physics, 117(10), 4643, 2002
7 Quantum-classical Liouville approach to molecular dynamics: Surface hopping Gaussian phase-space packets
Horenko I, Salzmann C, Schmidt B, Schutte C
Journal of Chemical Physics, 117(24), 11075, 2002
8 A theoretical model for molecules interacting with intense laser pulses: The Floquet-based quantum-classical Liouville equation
Horenko I, Schmidt B, Schutte C
Journal of Chemical Physics, 115(13), 5733, 2001
9 Quantum-Classical Molecular-Dynamics as an Approximation to Full Quantum Dynamics
Bornemann FA, Nettesheim P, Schutte C
Journal of Chemical Physics, 105(3), 1074, 1996