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19922026
most citedFast and Accurate Modeling of Molecular Atomization Energies with Machine Learning

2.4k citations

Showing 2021Show all

65 papers · 1 filter

quant-ph2021★ 10 cited

Realization of Heisenberg models of spin systems with polar molecules in pendular states

Wenjing Yue, Qi Wei, Sabre Kais +2

We show that ultracold polar diatomic or linear molecules, oriented in an external electric field and mutually coupled by dipole-dipole interactions, can be used to realize the exa…

physics.optics2021★ 12 cited

Infrared super-resolution wide-field microscopy using sum-frequency generation

Richarda Niemann, Sören Wasserroth, Guanyu Lu +6

Super-resolution microscopy in the visible is an established powerful tool in several disciplines. In the infrared (IR) spectral range, however, no comparable schemes have been dem…

physics.chem-ph2021★ 8 cited

Spectroscopic characterization of the a state of aluminum monofluoride

Nicole Walter, Maximilian Doppelbauer, Silvio Marx +6

Spectroscopic studies of aluminum monofluoride (AlF) have revealed its highly favorable properties for direct laser cooling. All lines of the strong A X$^1Σ^+…

physics.chem-ph2021★ 1 cited

Quantitative study of enantiomer-specific state transfer

JuHyeon Lee, Johannes Bischoff, A. O. Hernandez-Castillo +3

We here report on a quantitative study of Enantiomer-Specific State Transfer (ESST), performed in a pulsed, supersonic molecular beam. The chiral molecule 1-indanol is cooled to lo…

physics.atom-ph2021★ 23 cited

Hyperfine resolved optical spectroscopy of the AX transition in MgF

M. Doppelbauer, S. C. Wright, S. Hofsäss +3

We report on hyperfine-resolved laser spectroscopy of the AX transition of MgF, relevant for laser cooling. We recorded 25 rotational transitions with an abs…

physics.optics2021★ 130 cited

Spintronic Sources of Ultrashort Terahertz Electromagnetic Pulses

Tom S. Seifert, Liang Cheng, Zhengxing Wei +2

Spintronic terahertz emitters are novel, broadband and efficient sources of terahertz radiation, which emerged at the intersection of ultrafast spintronics and terahertz photonics.…

cond-mat.mes-hall2021★ 26 cited

Spin-voltage-driven efficient terahertz spin currents from the magnetic Weyl semimetals CoMnGa and CoMnAl

Genaro Bierhance, Anastasios Markou, Oliver Gueckstock +7

Magnetic Weyl semimetals are an emerging material class that combines magnetic order and a topologically non-trivial band structure. Here, we study ultrafast optically driven spin…

cond-mat.mes-hall2021★ 32 cited

Transition of laser-induced terahertz spin currents from torque- to conduction-electron-mediated transport

Pilar Jiménez-Cavero, Oliver Gueckstock, Lukáš Nádvorník +16

Spin transport is crucial for future spintronic devices operating at bandwidths up to the terahertz (THz) range. In F|N thin-film stacks made of a ferro/ferrimagnetic layer F and a…

physics.atom-ph2021★ 5 cited

Multiple photodetachment of silicon anions via K-shell excitation and ionization

A. Perry-Sassmannshausen, T. Buhr, M. Martins +5

Experimental cross sections for -fold photodetachment () of silicon anions via -shell excitation and ionization were measured in the photon-energy range of 1830-1900 e…

cond-mat.mes-hall2021★ 20 cited

Impact of gigahertz and terahertz transport regimes on spin propagation and conversion in the antiferromagnet IrMn

Oliver Gueckstock, Rafael L. Seeger, Tom S. Seifert +7

Control over spin transport in antiferromagnetic systems is essential for future spintronic applications with operational speeds extending to ultrafast time scales. Here, we study…

physics.atom-ph2021★ 16 cited

Ion and Electron Momentum Distributions from Single and Double Ionization of Helium Induced by Compton Scattering

M. Kircher, F. Trinter, S. Grundmann +18

We present the momentum distributions of the nucleus and of the electrons from double ionization of the helium atom by Compton scattering of photons with keV. We find that…

cond-mat.mtrl-sci2021★ 40 cited

Probing the energy conversion pathways between light, carriers and lattice in real time with attosecond core-level spectroscopy

T. P. H. Sidiropoulos, N. Di Palo, D. E. Rivas +16

Detection of the energy conversion pathways, between photons, charge carriers, and the lattice is of fundamental importance to understand fundamental physics and to advance materia…

physics.chem-ph2021★ 4 cited

Dynamics of translational and rotational thermalization of AlF molecules via collisions with cryogenic helium

Mallikarjun Karra, Miruna T. Cretu, Bretislav Friedrich +3

We investigated helium-mediated translational and rotational thermalization of the aluminum monofluoride (AlF) molecule at cryogenic temperatures via a new potential…

physics.atom-ph2021★ 39 cited

Observation of Chemical Reactions between a Trapped Ion and Ultracold Feshbach Dimers

H. Hirzler, R. S. Lous, E. Trimby +3

We measure chemical reactions between a single trapped Yb ion immersed in an ultracold bath of Li atoms containing trace amounts of Li dimers. This produces LiY…

cond-mat.mtrl-sci2021★ 18 cited

Intrinsic energy flow in laser-excited 3 ferromagnets

Daniela Zahn, Florian Jakobs, Hélène Seiler +6

Ultrafast magnetization dynamics are governed by energy flow between electronic, magnetic, and lattice degrees of freedom. A quantitative understanding of these dynamics must be ba…

physics.chem-ph2021★ 46 cited

A setup for studies of photoelectron circular dichroism from chiral molecules in aqueous solution

Sebastian Malerz, Henrik Haak, Florian Trinter +6

We present a unique experimental design that enables the measurement of photoelectron circular dichroism (PECD) from chiral molecules in aqueous solution. The effect is revealed fr…

cond-mat.mtrl-sci2021★ 28 cited

Photoinduced ultrafast transition of the local correlated structure in chalcogenide phase-change materials

Yingpeng Qi, Nianke Chen, Thomas Vasileiadis +4

Revealing the bonding and time-evolving atomic dynamics in functional materials with complex lattice structures can update the fundamental knowledge on rich physics therein, and al…

physics.chem-ph2021★ 29 cited

Ozone formation in ternary collisions: Theory and experiment reconciled

Marjan Mirahmadi, Jesús Pérez-Ríos, Oleg Egorov +2

Absorbing UV radiation, ozone protects life on Earth and plays a fundamental role in Earth's temperature balance. The formation of ozone occurs through the ternary recombination re…

cond-mat.mtrl-sci2021★ 19 cited

Trends in atomistic simulation software usage

Leopold Talirz, Luca M. Ghiringhelli, Berend Smit

Driven by the unprecedented computational power available to scientific research, the use of computers in solid-state physics, chemistry and materials science has been on a continu…

physics.chem-ph2021★ 20 cited

Classical threshold law for the formation of van der Waals molecules

Marjan Mirahmadi, Jesús Pérez-Ríos

We study the role of pairwise long-range interactions in the formation of van der Waals molecules through direct three-body recombination processes A + B + B AB + B,…

cond-mat.mtrl-sci2021

Excited-state band structure mapping

M. Puppin, C. W. Nicholson, C. Monney +10

Angle-resolved photoelectron spectroscopy is an extremely powerful probe of materials to access the occupied electronic structure with energy and momentum resolution. However, it r…

cond-mat.mtrl-sci2021★ 25 cited

Exchange scaling of ultrafast angular momentum transfer in 4 antiferromagnets

Y. W. Windsor, S-E. Lee, D. Zahn +11

Ultrafast manipulation of the magnetic state of matter bears great potential for future information technologies. While demagnetisation in ferromagnets is governed by dissipation o…

physics.chem-ph2021★ 11 cited

A New Design for a Traveling-Wave Zeeman Decelerator: II. Experiment

Tomislav Damjanovic, Stefan Willitsch, Nicolas Vanhaecke +4

A novel traveling-wave Zeeman decelerator based on a double-helix coil geometry capable of decelerating paramagnetic molecules with high efficiency is presented. Moving magnetic tr…

physics.chem-ph2021★ 8 cited

A New Design for a Traveling-Wave Zeeman Decelerator: I. Theory

Tomislav Damjanovic, Stefan Willitsch, Nicolas Vanhaecke +4

The concept of a novel traveling wave Zeeman deccelerator based on a double-helix wire geometry capable of decelerating paramagnetic species with high efficiency is presented. A mo…