RESPACK is a first-principles calculation software for evaluating the interaction parameters of materials and is able to calculate maximally localized Wannier functions, response functions based on the random phase approximation and related optical properties, and frequency-dependent electronic interaction parameters. RESPACK receives its input data from a band-calculation code using norm-conserving pseudopotentials with plane-wave basis sets. Automatic generation scripts that convert the band-structure results to the RESPACK inputs are prepared for xTAPP and Quantum ESPRESSO. An input file for specifying the RESPACK calculation conditions is designed pursuing simplicity and is given in the Fortran namelist format. RESPACK supports hybrid parallelization using OpenMP and MPI and can treat large systems including a few hundred atoms in the calculation cell.

中文翻译：

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RESPACK：用于推导有效低能材料模型的从头开始工具

RESPACK是用于评估材料相互作用参数的第一性原理计算软件，能够计算最大局域万尼尔函数、基于随机相位近似和相关光学特性的响应函数以及频率相关的电子相互作用参数。RESPACK 使用具有平面波基组的范数守恒赝势从频带计算代码接收其输入数据。为 xTAPP 和 Quantum ESPRESSO 准备了将能带结构结果转换为 RESPACK 输入的自动生成脚本。用于指定 RESPACK 计算条件的输入文件被设计为追求简单，并以 Fortran 名称列表格式给出。