Results 221 to 230 of about 4,375 (273)

Crystal Structure Prediction of Inorganic Materials: A Benchmark and Modern Evaluation

open access: yesAdvanced Intelligent Discovery, EarlyView.
Predicting a crystal’s structure from composition alone is a long‐standing challenge in materials discovery. The CSP180 benchmark of 180 inorganic crystals evaluates thirteen crystal structure prediction algorithms requiring no density functional theory (DFT) against DFT‐based baselines across twelve metrics.
Lai Wei   +9 more
wiley   +1 more source

LLM‐Based Multimodal Robotic Endoscope Control Framework for Enhancing Human–Robot Interaction in Minimally Invasive Surgery

open access: yesAdvanced Intelligent Systems, EarlyView.
An large language model‐powered multimodal framework is developed for robotic endoscope control. It integrates speech recognition and real‐time instrument tracking, achieving 89.47% command accuracy with ~1s latency for natural human–robot interaction in minimally invasive surgery.
Yisen Huang   +7 more
wiley   +1 more source

Latissimus Dorsi Free Flap: Subfascial Flap Dissection in a Case of Scalp and Forehead Reconstruction. [PDF]

open access: yesPlast Reconstr Surg Glob Open
Reynoso R   +3 more
europepmc   +1 more source

Diamondiyne: A 3D Carbon Allotrope With Mixed sp–sp3 Hybridization

open access: yesAngewandte Chemie, EarlyView.
A new carbon allotrope with mixed sp–sp3 hybridization has been synthesized through delicately controlled kinetics at a liquid–liquid interface. The resulting material, termed diamondiyne, exhibits an expanded diamond‐type network in the form of small crystallites in a continuous all‐carbon film.
Yizhou Yang   +12 more
wiley   +1 more source

Compositional and Structural Diversity in Cesium Superhydrides at High Pressure

open access: yesAngewandte Chemie, EarlyView.
Through high pressure‐high temperature diamond anvil cell experiments combined with density functional theory calculations, cesium is demonstrated to have remarkably complex and diverse hydride chemistry culminating in the formation of CsH25${\rm CsH}_{25}$, the most hydrogen‐rich metal hydride reported to date.
Mikhail A. Kuzovnikov   +7 more
wiley   +1 more source

Mechanism of Negative Thermal Expansion in Monoclinic Cu2P2O7 from First Principles. [PDF]

open access: yesJ Phys Chem Lett
Mochizuki Y   +4 more
europepmc   +1 more source

A Hybrid Ultramicroporous Material Family With Metal‐Controlled Dynamic Behavior

open access: yesAngewandte Chemie, EarlyView.
The hybrid ultramicroporous material (HUM) family NbOFFIVE‐3,3'‐bpy‐M exhibits metal‐dependent dynamic behavior upon exposure to water vapor. Whereas the Co and Ni variants undergo reversible lp→np→lp induced‐fit transformation, Cu and Zn exhibit a more typical np→lp mechanism.
Aizhamal Subanbekova   +9 more
wiley   +1 more source

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