OptiConvergenceMonitor {SCFMonitor}R Documentation

Read and Plot the Optimization Process of a Gaussian Log File.

Description

This function reads a log file automatically and shows the optimization convergence process of it by generating line plots

Arguments

directory

A string vector describing the directory of the Gaussian log file.

Value

No return value, called for side effects

Examples

library(readr)
library(stringr)
library(tidyselect)
library(dplyr)
library(tibble)
library(ggplot2)

OptiConvergenceMonitor(SCFMonitorExample())


[Package SCFMonitor version 0.3.5 Index]