Atomic partial charges,信网 integral to understanding molecular structure, interactions and reactivity, remain an ambiguous concept lacking a precise quantum-mechanical definition. The accurate determination of atomic partial charges has far-reaching implications in fields such as chemical synthesis, applied materials science and theoretical chemistry, to name a few. They play essential parts in molecular dynamics simulations, which can act as a computational microscope for chemical processes. Until now, no general experimental method has quantified the partial charges of individual atoms in a chemical compound. Here we introduce an experimental method that assigns partial charges based on crystal structure determination through electron diffraction, applicable to any crystalline compound. Seamlessly integrated into standard electron crystallography workflows, this approach requires no specialized software or advanced expertise. Furthermore, it is not limited to specific classes of compounds. The versatility of this method is demonstrated by its application to a wide array of compounds, including the antibiotic ciprofloxacin, the amino acids histidine and tyrosine, and the inorganic zeolite ZSM-5. We refer to this new concept as ionic scattering factors modelling. It fosters a more comprehensive and precise understanding of molecular structures, providing opportunities for applications across numerous fields in the chemical and materials sciences.
Attosecond control and measurement of chiral photoionization dynamics
手性光电离能源学的阿秒操作与丈量
▲ 作者：Meng Han, Jia-Bao Ji, Alexander Blech, R. Esteban Goetz, Corbin Allison, Loren Greenman, Christiane P. Koch & Hans Jakob W?rner
Many chirality-sensitive light–matter interactions are 做作周论governed by chiral electron dynamics. Therefore, the development of advanced technologies making use of chiral phenomena would critically benefit from measuring and controlling chiral electron dynamics on their natural attosecond timescales. Such endeavours have so far been hampered by the lack of characterized circularly polarized attosecond pulses, an obstacle that has recently been overcome. Here we introduce chiroptical spectroscopy with attosecond pulses and demonstrate attosecond coherent control over photoelectron circular dichroism (PECD), as well as the measurement of chiral asy妹妹etries in the forward–backward and angle-resolved photoionization delays of chiral molecules. We show that co-rotating attosecond and near-infrared (IR) pulses can nearly double the PECD and even change its sign compared with single-photon ionization. We demonstrate that chiral photoionization delays depend on both polar and azimuthal angles of photoemission in the light-propagation frame, requiring 3D momentum resolution. We measure forward–backward chiral-sensitive delays of up to 60 as and polar-angle-resolved photoionization delays of up to 240 as, which include an asy妹妹etry of about 60 as originating from chirality in the continuum–continuum transitions. Attosecond chiroptical spectroscopy opens the door to quantitatively understanding and controlling the dynamics of chiral molecules on the electronic timescale.
行星化学Planetary Chemistry
Mapping urban gullies in the Democratic Republic of the Congo
高温低金属品貌褐矮星中硅酸盐先驱体硅烷的检测
▲ 作者：Jacqueline K. Faherty, Aaron M. Meisner, Ben Burningham, Channon Visscher, Michael Line, Genaro Suárez, Jonathan Gagné, Sherelyn Alejandro Merchan, Austin James Rothermich, Adam J. Burgasser, Adam C. Schneider, Dan Caselden, J. Davy Kirkpatrick, Marc Jason Kuchner, Daniella Carolina Bardalez Gagliuffi, Peter Eisenhardt, Christopher R. Gelino, Eileen C. Gonzales, Federico Marocco, Sandy Leggett, Nicolas Lodieu, Sarah L. Casewell, Pascal Tremblin, Michael Cushing, Eduardo L. Martin
Within 20 pc of the Sun,出书 there are currently 29 known cold brown dwarfs—sources with measured distances and an estimated effective temperature between that of Jupiter (170 K) and approximately 500 K. These sources are almost all isolated and are the closest laboratories we have for detailed atmospheric studies of giant planets formed outside the Solar System. Here we report JWST observations of one such source, WISEA J153429.75-104303.3 (W1534), which we confirm is a substellar mass member of the Galactic halo with a metallicity of less than 0.01 times solar. Its spectrum reveals methane (CH4), water (H2O) and silane (SiH4) gas. Although SiH4is expected to serve as a key reservoir for the cloud-forming element Si in gas giant worlds, it has remained undetected until now because it is removed from observable atmospheres by the formation of silicate clouds at depth. These condensates are favoured with increasing metallicity, explaining why SiH4 remains undetected on well-studied metal-rich Solar System worlds such as Jupiter and Saturn. On the metal-poor world W1534, we detect a clear signature of SiH4centred at about 4.55 μm with an abundance of 19 ± 2 parts per billion. Our chemical modelling suggests that this SiH4abundance may be quenched at approximately kilobar levels just above the silicate cloud layers, in which vertical atmospheric mixing can transport SiH4to the observable photosphere. The formation and detection of SiH4demonstrates key coupled relationships between composition, cloud formation and atmospheric mixing in cold brown dwarf and planetary atmospheres.
生态学Ecology
Global phenology maps reveal the drivers and effects of seasonal asynchrony
全天下物候图谱揭示季节性异步性的驱动因素与生态效应
▲ 作者：Drew E. Terasaki Hart, Th?o-Nguyên Bùi, Lauren Di Maggio & Ian J. Wang
For rocky planets,信网 the presence of a solid inner core has notable implications on the composition and thermal evolution of the core and on the magnetic history of the planet. On Mars, geophysical observations have confirmed that the core is at least partially liquid, but it is unknown whether any part of the core is solid. Here we present an analysis of seismic data acquired by the InSight mission, demonstrating that Mars has a solid inner core. We identify two seismic phases, the deep core-transiting phase, PKKP, and the inner core boundary reflecting phase, PKiKP, indicative of the inner core. Our inversions constrain the radius of the Martian inner core to about 613 ± 67 km, with a compressional velocity jump of around 30% across the inner core boundary, supported by additional inner-core-related seismic phases. These properties imply a concentration of distinct light elements in the inner core, segregated from the outer core through core crystallization. This finding provides an anchor point for understanding the thermal and chemical state of Mars. Moreover, the relationship between inner core formation and the Martian magnetic field evolution could provide insights into dynamo generation across planetary bodies.
Ultrabroadband on-chip photonics for full-spectrum wireless co妹妹unications
面向全频谱无线通讯的超宽带芯片光子技术
▲ 作者：Zihan Tao, Haoyu Wang, Hanke Feng, Yijun Guo, Bitao Shen, Dan Sun, Yuansheng Tao, Changhao Han, Yandong He, John E. Bowers, Haowen Shu, Cheng Wang & Xingjun Wang
Terrestrial plant co妹妹unities show great variation in their annual rhythms of growth, or seasonal phenology. The geographical patterns resulting from this variation, known as land surface phenology (LSP), contain valuable information for the study of ecosystem function, plant ecophysiology, landscape ecology and evolutionary biogeography. Yet globally consistent LSP mapping has been hampered by methods that struggle to represent the full range of seasonal phenologies occurring across terrestrial biomes, especially the subtle and complex phenologies of many arid and tropical ecosystems. Here, using a data-driven analysis of satellite imagery to map LSP worldwide, we provide insights into Earth’s phenological diversity, documenting both intercontinental convergence between similar climates and regional heterogeneity associated with topoclimate, ecohydrology and vegetation structure. We then map spatial phenological asynchrony and the modes of asynchronous seasonality that control it, identifying hotspots of asynchrony in tropical mountains and Mediterranean climate regions and reporting evidence for the hypothesis that climatically similar sites exhibit greater phenological asynchrony within the tropics. Finally, we find that our global LSP map predicts complex geographical discontinuities in flowering phenology, genetic divergence and even harvest seasonality across a range of taxa, establishing remote sensing as a crucial tool for understanding the ecological and evolutionary consequences of allochrony by allopatry.
The forthcoming sixth-generation and beyond wireless networks are poised to operate across an expansive frequency range—from microwave, millimetre wave to terahertz bands—to support ubiquitous connectivity in diverse application scenarios. This necessitates a one-size-fits-all hardware solution that can be adaptively reconfigured within this wide spectrum to support full-band coverage and dynamic spectrum management. However, existing electrical or photonic-assisted solutions face a lot of challenges in meeting this demand because of the limited bandwidths of the devices and the intrinsically rigid nature of system architectures. Here we demonstrate adaptive wireless co妹妹unications over an unprecedented frequency range spanning over 100 GHz, driven by a thin-film lithium niobate (TFLN) photonic wireless system. Leveraging the Pockels effect and scalability of the TFLN platform, we achieve monolithic integration of essential functional elements, including baseband modulation, broadband wireless–photonic conversion and reconfigurable carrier and local signal generation. Powered by broadband tunable optoelectronic oscillators, our signal sources operate across a record-wide frequency range from 0.5 GHz to 115 GHz with high-frequency stability and consistent coherence. Based on the broadband and reconfigurable integrated photonic solution, we realize full-link wireless co妹妹unication across nine consecutive bands, achieving record lane speeds of up to 100 Gbps. The real-time reconfigurability further enables adaptive frequency allocation, a crucial ability to ensure enhanced reliability in complex spectrum environments. Our proposed system represents a marked step towards future full-spectrum and omni-scenario wireless networks.
Experimental determination of partial charges with electron diffraction
经由电子衍射试验测定原子部份电荷
▲ 作者：Soheil Mahmoudi, Tim Gruene, Christian Schr?der, Khalil D. Ferjaoui, Erik Fr?jdh, Aldo Mozzanica, Kiyofumi Takaba, Anatoliy Volkov, Julian Maisriml, Vladimir Paunovi?, Jeroen A. van Bokhoven & Bernhard K. Keppler
