“…Hydrogen segregation has often been studied at vacancy [14], surfaces [15,16], grain boundaries [2,14,[17][18][19][20][21][22][23], and dislocations [24][25][26][27][28][29][30]. For dislocations, hydrogen segregation was modeled either using elastic theory [31,32], Molecular Statics or Monte-Carlo (MC) simulations with semi-empirical potentials [31,[33][34][35], or using ab initio calculations to obtain energetic interactions used as input data in rigid-lattice MC simulations or mean-field (MF) models [25,29,30,36,37].…”