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Recent advances in scanning transmission electron and scanning probe microscopies have opened exciting opportunities in probing the materials structural parameters and various functional properties in real space with angstrom-level…
We present a novel data-driven trap theory (abbreviated as DDTT) for nuclear scattering, which aims to overcome the limitations of the traditional trap method in dealing with narrow potential wells, while also providing a more efficient…
Deep learning (DL) techniques have been used to support several code-related tasks such as code summarization and bug-fixing. In particular, pre-trained transformer models are on the rise, also thanks to the excellent results they achieved…
Transfer learning allows us to train deep architectures requiring a large number of learned parameters, even if the amount of available data is limited, by leveraging existing models previously trained for another task. Here we explore the…
High-throughput computational screening has emerged as a critical component of materials discovery. Direct density functional theory (DFT) simulation of inorganic materials and molecular transition metal complexes is often used to describe…
Deep Reinforcement Learning (DRL) emerges as a prime solution for Unmanned Aerial Vehicle (UAV) trajectory planning, offering proficiency in navigating high-dimensional spaces, adaptability to dynamic environments, and making sequential…
The present work shows the application of transfer learning for a pre-trained deep neural network (DNN), using a small image dataset ($\approx$ 12,000) on a single workstation with enabled NVIDIA GPU card that takes up to 1 hour to complete…
In this paper, we consider the problem of developing predictive models with limited data for energy assets such as electricity loads, PV power generations, etc. We specifically investigate the cases where the amount of historical data is…
Increased complexity and heterogeneity of emerging 5G and beyond 5G (B5G) wireless networks will require a paradigm shift from traditional resource allocation mechanisms. Deep learning (DL) is a powerful tool where a multi-layer neural…
Interatomic potentials learned using machine learning methods have been successfully applied to atomistic simulations. However, accurate models require large training datasets, while generating reference calculations is computationally…
We investigate how neural networks (NNs) understand physics using 1D quantum mechanics. After training an NN to accurately predict energy eigenvalues from potentials, we used it to confirm the NN's understanding of physics from four…
Reinforcement Learning (RL) enables an intelligent agent to optimise its performance in a task by continuously taking action from an observed state and receiving a feedback from the environment in form of rewards. RL typically uses tables…
Modern deep neural network (DNN) systems are highly configurable with large a number of options that significantly affect their non-functional behavior, for example inference time and energy consumption. Performance models allow to…
We present a physically-motivated topology of a deep neural network that can efficiently infer extensive parameters (such as energy, entropy, or number of particles) of arbitrarily large systems, doing so with O(N) scaling. We use a form of…
With electric power systems becoming more compact and increasingly powerful, the relevance of thermal stress especially during overload operation is expected to increase ceaselessly. Whenever critical temperatures cannot be measured…
Deep subsurface exploration is important for mining, oil and gas industries, as well as in the assessment of geological units for the disposal of chemical or nuclear waste, or the viability of geothermal energy systems. Typically, detailed…
Structural condition identification based on monitoring data is important for automatic civil infrastructure asset management. Nevertheless, the monitoring data is almost always insufficient, because the real-time monitoring data of a…
The use of transfer learning (TL) techniques has become common practice in fields such as computer vision (CV) and natural language processing (NLP). Leveraging prior knowledge gained from data with different distributions, TL offers higher…
Accurate ab-initio prediction of electronic energies is very expensive for macromolecules by explicitly solving post-Hartree-Fock equations. We here exploit the physically justified local correlation feature in compact basis of small…
Physics-informed neural networks have been widely applied to partial differential equations with great success because the physics-informed loss essentially requires no observations or discretization. However, it is difficult to optimize…