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From the 1 of 4.4k papers with an AI index.

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20022025
most citedQuantum ESPRESSO: a modular and open-source software project for quantum simulations of materials

29.3k citations

Showing 2020Show all

353 papers · 1 filter

cs.LG202017 cited

DeepSphere: a graph-based spherical CNN

Michaël Defferrard, Martino Milani, Frédérick Gusset +1

Designing a convolution for a spherical neural network requires a delicate tradeoff between efficiency and rotation equivariance. DeepSphere, a method based on a graph representati…

cond-mat.mtrl-sci20203 cited

Efficient partitioning of surface Green's function: toward ab initio contact resistance study

Guido Gandus, Youseung Lee, Daniele Passerone +1

In this work, we propose an efficient computational scheme for first-principle quantum transport simulations to evaluate the open-boundary conditions. Its partitioning differentiat…

cond-mat.stat-mech202011 cited

Self-consistent harmonic approximation with non-local couplings

Guido Giachetti, Nicolo Defenu, Stefano Ruffo +1

We derive the self-consistent harmonic approximation for the XY model with non-local interactions. The resulting equation for the variational couplings holds for any form of t…

physics.med-ph2020

Simulation of Intravoxel Incoherent Perfusion Signal Using a Realistic Capillary Network of a Mouse Brain

Valerie Phi van, Franca Schmid, Georg Spinner +2

Purpose: To simulate the intravoxel incoherent perfusion magnetic resonance magnitude signal from the motion of blood particles in three realistic vascular network graphs from a mo…

cs.AR202062 cited

EdgeDRNN: Recurrent Neural Network Accelerator for Edge Inference

Chang Gao, Antonio Rios-Navarro, Xi Chen +2

Low-latency, low-power portable recurrent neural network (RNN) accelerators offer powerful inference capabilities for real-time applications such as IoT, robotics, and human-machin…

cs.LG20202 cited

Suspicious Massive Registration Detection via Dynamic Heterogeneous Graph Neural Networks

Susie Xi Rao, Shuai Zhang, Zhichao Han +6

Massive account registration has raised concerns on risk management in e-commerce companies, especially when registration increases rapidly within a short time frame. To monitor th…