研究论文开放获取

QEHeat: An open-source energy flux calculator for the computation of heat-transport coefficients from first principles

Aris Marcolongo, Riccardo Bertossa, Davide Tisi, Stefano Baroni

University of Bern　Scuola Internazionale Superiore di Studi Avanzati　Istituto Officina dei Materiali

来源Computer Physics Communications

年份2021

DOI10.1016/j.cpc.2021.108090

原文https://doi.org/10.1016/j.cpc.2021.108090

阅读操作

确认中

在文库中上传 PDF 后可生成中文音频讲解。

摘要与影响

摘要 · 节选

暂未获取摘要。可打开原文或 PDF，后续可基于全文生成更完整的速读。

逐年被引趋势

420

424

关键指标

被引次数 · OpenAlex

1.80

领域内被引倍数
同类平均 = 1

前 18%

引用位次
同领域 · 同年份 · 同类型

参考文献

Google Scholar 与 OpenAlex 的被引统计范围不同，数值存在差异属正常。

AI 辅助阅读

依据：文献信息

论文问答

当前基于文献信息回答

可就本文提问；依据不足时会说明。

学术脉络

学科主题

物理

High-pressure geophysics and materials

Thermal properties of materials · Advanced Chemical Physics Studies

参考文献 28

Stefano Baroni, Stefano de Gironcoli, Andrea Dal Corso · Reviews of Modern Physics · 2001

被引 10,011

Markoff Random Processes and the Statistical Mechanics of Time-Dependent Phenomena. II. Irreversible Processes in Fluids

Melville S. Green · The Journal of Chemical Physics · 1954

被引 1,836

Microscopic theory and quantum simulation of atomic heat transport

Aris Marcolongo, Paolo Umari, Stefano Baroni · Nature Physics · 2015

被引 138

此处列出前 3 条

引用本文 12

Heat transport in liquid water from first-principles and deep neural network simulations

Davide Tisi, Linfeng Zhang, Riccardo Bertossa · Physical review. B./Physical review. B · 2021

被引 71

Temperature- and vacancy-concentration-dependence of heat transport in Li3ClO from multi-method numerical simulations

Paolo Pegolo, Stefano Baroni, Federico Grasselli · npj Computational Materials · 2022

被引 35

Invariance principles in the theory and computation of transport coefficients

Federico Grasselli, Stefano Baroni · The European Physical Journal B · 2021

被引 29

按被引量排序，此处列出前 3 条