Results 261 to 270 of about 1,253,716 (311)

Toward efficient quantum computation of molecular ground‐state energies

open access: yesAIChE Journal, EarlyView.
Abstract Variational quantum eigensolvers (VQEs) represent a promising approach to computing molecular ground states and energies on modern quantum computers. These approaches use a classical computer to optimize the parameters of a trial wave function, while the quantum computer simulates the energy by preparing and measuring a set of bitstring ...
Farshud Sorourifar   +8 more
wiley   +1 more source

Olefin separation from FCC naphtha by deep eutectic solvents: PC‐SAFT modeling and molecular insights

open access: yesAIChE Journal, EarlyView.
Abstract Olefin extractive separation from fluid catalytic cracking (FCC) naphtha with deep eutectic solvents (DESs) was systematically investigated in this work. In a first step, different DESs were screened for their separation performance of the binary mixture benzene/1‐hexene.
Gangqiang Yu   +6 more
wiley   +1 more source

In Situ Graph Reasoning and Knowledge Expansion Using Graph‐PRefLexOR

open access: yesAdvanced Intelligent Discovery, EarlyView.
Graph‐PRefLexOR is a novel framework that enhances language models with in situ graph reasoning, symbolic abstraction, and recursive refinement. By integrating graph‐based representations into generative tasks, the approach enables interpretable, multistep reasoning.
Markus J. Buehler
wiley   +1 more source

Designing Memristive Materials for Artificial Dynamic Intelligence

open access: yesAdvanced Intelligent Discovery, EarlyView.
Key characteristics required of memristors for realizing next‐generation computing, along with modeling approaches employed to analyze their underlying mechanisms. These modeling techniques span from the atomic scale to the array scale and cover temporal scales ranging from picoseconds to microseconds. Hardware architectures inspired by neural networks
Youngmin Kim, Ho Won Jang
wiley   +1 more source

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