Journal Article (272)
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Journal Article
31 (46), 2104061 (2021)
In Situ Synthesis of Molybdenum Carbide Nanoparticles Incorporated into Laser-Patterned Nitrogen-Doped Carbon for Room Temperature VOC Sensing. Advanced Functional Materials 242.
Journal Article
154 (5), 054307 (2021)
The sequential activation of H2 and N2 mediated by the gas-phase Sc3N+ clusters: Formation of amido unit. The Journal of Chemical Physics 243.
Journal Article
125 (25), pp. 5670 - 5680 (2021)
Complex Reaction Network Thermodynamic and Kinetic Autoconstruction Based on Ab Initio Statistical Mechanics: A Case Study of O2 Activation on Ag4 Clusters. The Journal of Physical Chemistry A 244.
Journal Article
22 (6), 2917 (2021)
Graphene Coating Obtained in a Cold-Wall CVD Process on the Co-Cr Alloy (L-605) for Medical Applications. International Journal of Molecular Sciences 245.
Journal Article
60 (17), pp. 9301 - 9305 (2021)
Zeolite-Stabilized Di- and Tetranuclear Molybdenum Sulfide Clusters Form Stable Catalytic Hydrogenation Sites. Angewandte Chemie International Edition 246.
Journal Article
60 (17), pp. 9387 - 9391 (2021)
Zeolite-Stabilized Di- and Tetranuclear Molybdenum Sulfide Clusters Form Stable Catalytic Hydrogenation Sites. Angewandte Chemie 247.
Journal Article
12 (12), pp. 4536 - 4546 (2021)
Data-efficient machine learning for molecular crystal structure prediction. Chemical Science 248.
Journal Article
126 (14), 147202 (2021)
Exchange-Striction Driven Ultrafast Nonthermal Lattice Dynamics in NiO. Physical Review Letters 249.
Journal Article
11 (2), pp. 734 - 742 (2021)
Data-Driven Descriptor Engineering and Refined Scaling Relations for Predicting Transition Metal Oxide Reactivity. ACS Catalysis 250.
Journal Article
412, 125226 (2021)
Potential hazards of novel waste-derived sorbents for efficient removal of mercury from coal combustion flue gas. Journal of Hazardous Materials 251.
Journal Article
8 (2), 025012 (2021)
Ultrafast photocurrents in MoSe2 probed by terahertz spectroscopy. 2D Materials 252.
Journal Article
11 (6), 554 (2021)
Protein Secondary Structure Affects Glycan Clustering in Native Mass Spectrometry. Life 253.
Journal Article
60 (25), pp. 13788 - 13792 (2021)
Catalytic Co-Conversion of CH4 and CO2 Mediated by Rhodium-Titanium Oxide Anions RhTiO2-. Angewandte Chemie International Edition 254.
Journal Article
133 (25), pp. 13907 - 13911 (2021)
Gemeinsame katalytische Umsetzung von CH4 und CO2 durch Rhodium-Titanoxid-Anionen RhTiO2-. Angewandte Chemie 255.
Journal Article
4 (6), pp. 5912 - 5920 (2021)
First-Principles Calculations of Heteroanionic Monochalcogenide Alloy Nanosheets with Direction-dependent Properties for Anisotropic Optoelectronics. ACS Applied Nano Materials 256.
Journal Article
27 (1), pp. 121 - 128 (2021)
Dynamic Imaging of Nanostructures in an Electrolyte with a Scanning Electron Microscope. Microscopy and Microanalysis 257.
Journal Article
127 (20), 207401 (2021)
Efficient First-Principles Methodology for the Calculation of the All-Phonon Inelastic Scattering in Solids. Physical Review Letters 258.
Journal Article
104 (20), 205109 (2021)
Multiphonon diffuse scattering in solids from first-principles: Application to layered crystals and two-dimensional materials. Physical Review B 259.
Journal Article
3 (2), 023032 (2021)
Lattice dynamics and ultrafast energy flow between electrons, spins, and phonons in a 3d ferromagnet. Physical Review Research 260.
Journal Article
8 (6), 064301 (2021)
Ultrafast lattice dynamics and electron-phonon coupling in platinum extracted with a global fitting approach for time-resolved polycrystalline diffraction data. Structural Dynamics