| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
A comprehensive study of Interatomic Coulombic Decay in argon dimers: Extracting R-dependent absolute decay rates from the experiment
|
Rist, J.
|
|
2017
|
482 |
C |
p. 185-191
|
artikel
|
| 2 |
A four-component Fock-space coupled cluster investigation of the XMn(CO)5, (X=Cl, Br and I) photoelectron spectra
|
Nikoobakht, Behnam
|
|
2017
|
482 |
C |
p. 339-345
|
artikel
|
| 3 |
Algebraic diagrammatic construction for the polarization propagator with spin-orbit coupling
|
Krauter, Caroline M.
|
|
2017
|
482 |
C |
p. 286-293
|
artikel
|
| 4 |
An analysis of nonadiabatic ring-polymer molecular dynamics and its application to vibronic spectra
|
Richardson, Jeremy O.
|
|
2017
|
482 |
C |
p. 124-134
|
artikel
|
| 5 |
A novel system-bath Hamiltonian for vibration-phonon coupling: Formulation, and application to the relaxation of Si–H and Si–D bending modes of H/D:Si(100)-(2×1)
|
Lorenz, U.
|
|
2017
|
482 |
C |
p. 69-80
|
artikel
|
| 6 |
A Spin-Boson Screening approach for unraveling dominant vibrational energy transfer pathways in molecular materials
|
Chuntonov, Lev
|
|
2017
|
482 |
C |
p. 93-99
|
artikel
|
| 7 |
Auger decay rates of core hole states using equation of motion coupled cluster method
|
Ghosh, Aryya
|
|
2017
|
482 |
C |
p. 160-164
|
artikel
|
| 8 |
Benchmarking singlet and triplet excitation energies of molecular semiconductors for singlet fission: Tuning the amount of HF exchange and adjusting local correlation to obtain accurate functionals for singlet–triplet gaps
|
Brückner, Charlotte
|
|
2017
|
482 |
C |
p. 319-338
|
artikel
|
| 9 |
Charge-transfer contributions to the excitonic coupling matrix element in BODIPY-based energy transfer cassettes
|
Spiegel, J. Dominik
|
|
2017
|
482 |
C |
p. 265-276
|
artikel
|
| 10 |
Collective excitations of dipolar gases based on local tunneling in superlattices
|
Cao, Lushuai
|
|
2017
|
482 |
C |
p. 303-310
|
artikel
|
| 11 |
Contents
|
|
|
2017
|
482 |
C |
p. v-xvi
|
artikel
|
| 12 |
Derivation of the one electron orbital which is associated with the best separable function of a given many electron reference state
|
Šindelka, Milan
|
|
2017
|
482 |
C |
p. 384-386
|
artikel
|
| 13 |
Electronic decay through carbon chains
|
Kuleff, Alexander I.
|
|
2017
|
482 |
C |
p. 216-220
|
artikel
|
| 14 |
Electrons and nuclei in motion: Correlation and dynamics in molecules
|
Dreuw, Andreas
|
|
2017
|
482 |
C |
p. 1-2
|
artikel
|
| 15 |
Electron transfer mediated decay in NeXe triggered by K-LL Auger decay of Ne
|
Stumpf, Vasili
|
|
2017
|
482 |
C |
p. 192-200
|
artikel
|
| 16 |
Finite-temperature second-order many-body perturbation theory revisited
|
Santra, Robin
|
|
2017
|
482 |
C |
p. 355-361
|
artikel
|
| 17 |
Fluorescence cascades evoked by resonant interatomic Coulombic decay of inner-valence excited neon clusters
|
Hans, Andreas
|
|
2017
|
482 |
C |
p. 165-168
|
artikel
|
| 18 |
H+CH4 →H2 +CH3 initial state-selected reaction probabilities on different potential energy surfaces
|
Ellerbrock, Roman
|
|
2017
|
482 |
C |
p. 106-112
|
artikel
|
| 19 |
IFC (Editorial Board)
|
|
|
2017
|
482 |
C |
p. IFC
|
artikel
|
| 20 |
Interatomic Coulombic decay and electron-transfer-mediated decay following triple ionization of Ne2 and NeAr
|
Ouchi, T.
|
|
2017
|
482 |
C |
p. 244-248
|
artikel
|
| 21 |
Interatomic Coulombic Decay of HeNe dimers after ionization and excitation of He and Ne
|
Sann, H.
|
|
2017
|
482 |
C |
p. 221-225
|
artikel
|
| 22 |
Ion pair formation in the NeAr dimer irradiated by monochromatic soft X-rays
|
Ouchi, T.
|
|
2017
|
482 |
C |
p. 178-184
|
artikel
|
| 23 |
Low-lying π∗ resonances associated with cyano groups: A CAP/SAC-CI study
|
Ehara, Masahiro
|
|
2017
|
482 |
C |
p. 169-177
|
artikel
|
| 24 |
On the computations of decay widths of Fano resonances
|
Miteva, T.
|
|
2017
|
482 |
C |
p. 208-215
|
artikel
|
| 25 |
On the infrared absorption spectrum of the hydrated hydroxide ( H 3 O 2 - ) cluster anion
|
Peláez, Daniel
|
|
2017
|
482 |
C |
p. 100-105
|
artikel
|
| 26 |
On the Jahn–Teller effect in the X ∼ 2 E electronic ground state of CH3F+
|
Sarkar, Rudraditya
|
|
2017
|
482 |
C |
p. 39-51
|
artikel
|
| 27 |
On the time-dependent calculation of angular averaged vibronic absorption spectra with an application to molecular aggregates
|
Brüning, Christoph
|
|
2017
|
482 |
C |
p. 64-68
|
artikel
|
| 28 |
Photoelectron circular dichroism of isopropanolamine
|
Catone, D.
|
|
2017
|
482 |
C |
p. 294-302
|
artikel
|
| 29 |
Pruned bases that are compatible with iterative eigensolvers and general potentials: New results for CH3CN
|
Avila, Gustavo
|
|
2017
|
482 |
C |
p. 3-8
|
artikel
|
| 30 |
Quantum control of electronic fluxes during adiabatic attosecond charge migration in degenerate superposition states of benzene
|
Jia, Dongming
|
|
2017
|
482 |
C |
p. 146-159
|
artikel
|
| 31 |
Reflections on one dimensional transmission
|
Klaiman, Shachar
|
|
2017
|
482 |
C |
p. 277-285
|
artikel
|
| 32 |
Resonant photoelectron imaging of deprotonated uracil anion via vibrational levels of a dipole-bound excited state
|
Huang, Dao-Ling
|
|
2017
|
482 |
C |
p. 374-383
|
artikel
|
| 33 |
Selected boron, aluminum, and gallium trihalide and trihydride anions
|
Brzeski, Jakub
|
|
2017
|
482 |
C |
p. 387-392
|
artikel
|
| 34 |
Simulation of X-ray transient absorption for following vibrations in coherently ionized F2 molecules
|
Dutoi, Anthony D.
|
|
2017
|
482 |
C |
p. 249-264
|
artikel
|
| 35 |
Single and double carbon vacancies in pyrene as first models for graphene defects: A survey of the chemical reactivity toward hydrogen
|
Nieman, Reed
|
|
2017
|
482 |
C |
p. 346-354
|
artikel
|
| 36 |
Solvable model of a trapped mixture of Bose–Einstein condensates
|
Klaiman, Shachar
|
|
2017
|
482 |
C |
p. 362-373
|
artikel
|
| 37 |
Stabilization calculations of the low-lying temporary anions states of Be, Mg, and Ca
|
Falcetta, Michael F.
|
|
2017
|
482 |
C |
p. 239-243
|
artikel
|
| 38 |
Strong field control of the interatomic Coulombic decay process in quantum dots
|
Haller, Anika
|
|
2017
|
482 |
C |
p. 135-145
|
artikel
|
| 39 |
The complex-scaled multiconfigurational spin-tensor electron propagator method for low-lying shape resonances in Be−, Mg− and Ca−
|
Tsogbayar, Tsednee
|
|
2017
|
482 |
C |
p. 201-207
|
artikel
|
| 40 |
The DNA nucleobase thymine in motion – Intersystem crossing simulated with surface hopping
|
Mai, Sebastian
|
|
2017
|
482 |
C |
p. 9-15
|
artikel
|
| 41 |
Theoretical and experimental investigation of Electron Transfer Mediated Decay in ArKr clusters
|
Fasshauer, Elke
|
|
2017
|
482 |
C |
p. 226-238
|
artikel
|
| 42 |
Theoretical study of the initial non-radiative 1 B u →2 A g transition in the fluorescence quenching of s-trans-butadiene: Electronic structure methods and quantum dynamics
|
Komainda, A.
|
|
2017
|
482 |
C |
p. 27-38
|
artikel
|
| 43 |
Towards a systematic convergence of Multi-Layer (ML) Multi-Configuration Time-Dependent Hartree nuclear wavefunctions: The ML-spawning algorithm
|
Mendive-Tapia, David
|
|
2017
|
482 |
C |
p. 113-123
|
artikel
|
| 44 |
Ultrafast exciton migration in an HJ-aggregate: Potential surfaces and quantum dynamics
|
Binder, Robert
|
|
2017
|
482 |
C |
p. 16-26
|
artikel
|
| 45 |
Using quantum dynamics simulations to follow the competition between charge migration and charge transfer in polyatomic molecules
|
Spinlove, K.E.
|
|
2017
|
482 |
C |
p. 52-63
|
artikel
|
| 46 |
Vibrational energy transport in acetylbenzonitrile described by an ab initio-based quantum tier model
|
Fujisaki, Hiroshi
|
|
2017
|
482 |
C |
p. 86-92
|
artikel
|
| 47 |
Vibrational energy transport in molecules and the statistical properties of vibrational modes
|
Pandey, Hari Datt
|
|
2017
|
482 |
C |
p. 81-85
|
artikel
|
| 48 |
Vibrational properties of fractionally charged molecules and their relevance for molecular electronics and electrochemistry
|
Bâldea, Ioan
|
|
2017
|
482 |
C |
p. 311-318
|
artikel
|
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