Results 191 to 200 of about 2,792,267 (292)

RNA design: update on computational frameworks and programs for inverse RNA folding. [PDF]

Brief Bioinform
Mukherjee S, Zakh R, Churkin A, Barash D.   +3 more
europepmc   +1 more source

Phase‐Dependent Oxygen Defect Energetics in Epitaxial NbN/AlN/NbN Films

Advanced Science, EarlyView.
Phase dependent oxygen defect energetics in epitaxial δ‐NbN/AlN/δ‐NbN and β‐Nb2N/AlN/β‐Nb2N trilayers. Atomic‐scale analysis and first‐principles calculations reveal distinct oxygen incorporation pathways across NbN polymorphs. Layer resolved defect formation energies show that O is energetically more favorable within δ‐NbN electrodes, whereas in β ...
Prachi Garg, Kedarsh Kaushik, Danqing Wang, Naomi Pieczulewski, Anand Ithepalli, John Wright, Debdeep Jena, David A. Muller, Hong X. Tang, Cyrus Dreyer, Baishakhi Mazumder   +10 more
wiley   +1 more source

Irreversibility Factor and Limiting Performance of Financial Systems (Thermodynamic Approach) [PDF]

Anatoliy M. Tsirlin, Valdimir Kazakov
core  

High‐Entropy Engineering and External Magnetic Field Modulation Synergistically Enhance the H2S Sensing Performance of Rare‐Earth Perovskite Ferrites

Advanced Science, EarlyView.
A novel high‐entropy perovskite oxide, (Gd0.2Tb0.2Dy0.2Ho0.2Er0.2)FeO3, was successfully synthesized for advanced hydrogen sulfide gas detection. By synergistically coupling high‐entropy‐induced local lattice distortion with weak magnetic field modulation, the tailored material generates abundant active sites. This innovative dual strategy dramatically
Yunfei Wang, Min Zhang, Rui Li, Xiaolong Yao, Zhaofeng Wu, Fengdong Qu, Shan Qiu, Zhenjiang Li   +7 more
wiley   +1 more source

Thermo-Kinetic Framework for TGA Curve Modeling and Evaporation Enthalpy Determination in Composite Materials: The Case of Bone-Derived Hydroxyapatite. [PDF]

J Phys Chem B
Bernal-Alvarez LR, Santamaria-Holek I, Rivera-Armenta JL, Ramirez-Gutierrez CF.   +3 more
europepmc   +1 more source

Trace Li Pre‐Doping of Activated Carbon Cathode Enabling Accelerated Li‐Ion Transport for High‐Power Lithium‐Ion Capacitors

Advanced Science, EarlyView.
Trace‐level Li pre‐doping on activated carbon cathodes is demonstrated to significantly enhance Li‐ion transport and high‐rate performance in lithium‐ion capacitors. An ultrathin Li2CO3 interfacial layer, formed through controlled thermal conversion, facilitates rapid ion transport without pore blockage.
Kyungmin Do, Jihyeon Ryu, Dong Gyun Im, Seong‐Yong Kim, Tae‐Hyun Kwon, Byeong Guk Kim, Seojin Jeon, Woosun Jang, Myoung Joon Hwang, Ki‐Hun Nam, Seung Yol Jeong, Ick‐Jun Kim, Seungwook Eom, Jaeik Hyun, Sunhye Yang   +14 more
wiley   +1 more source

Exergy and DFT-Based Thermodynamic Analysis of a Rankine-VCR Marine Waste Heat Recovery System. [PDF]

Molecules
Keven A, Akçay E, Gümüş H.
europepmc   +1 more source

Trustworthy Multimodal Attention Framework for Creep Rupture Life Prediction Under Data‐Scarce Conditions: A Case Study on IN718

Advanced Science, EarlyView.
An attention‐based multimodal deep learning framework is developed to predict the creep life of Ni‐based superalloys by fusing processing parameters with microstructural micrographs. The model achieves high accuracy (R2 = 0.92), aligns with metallurgical principles by capturing δ‐phase influence, and incorporates uncertainty quantification, offering a ...
Haopeng Lv, Dayong Wu, Ziyuan Rao, Qian Wang, Haikun Ma, Jie Kang, Wang Li, Huicong Dong, Yandong Wang, Zhinan Yang, Ru Su   +10 more
wiley   +1 more source

Intelligent Computing for Future Layered Cathodes in Sodium-Ion Batteries. [PDF]

Small
Liu Q, Fei Z, Shi J, Hu F, Shen Y, Kan H, Zhang Y, Dong H, Meng Q, Dong P, Zhang Y.   +10 more
europepmc   +1 more source