Publicaciones (77) Publicaciones de IVAN CABRIA ALVARO

2022

  1. Assessment of density functional approximations for N2 and CO2 physisorption on benzene and graphene

    Journal of Computational Chemistry, Vol. 43, Núm. 21, pp. 1403-1419

  2. Grand Canonical Monte Carlo simulations of the hydrogen storage capacities of slit-shaped pores, nanotubes and torusenes

    International Journal of Hydrogen Energy, Vol. 47, Núm. 23, pp. 11916-11928

2018

  1. Analysis of the Symmetry Properties of Large Periodic Magnetic Systems, to Reduce the Computation Time of the Calculation of the Magnetostatic Dipolar Energy

    Proceedings - IEEE 2018 International Congress on Cybermatics: 2018 IEEE Conferences on Internet of Things, Green Computing and Communications, Cyber, Physical and Social Computing, Smart Data, Blockchain, Computer and Information Technology, iThings/GreenCom/CPSCom/SmartData/Blockchain/CIT 2018

  2. DFT simulation of hydrogen storage on manganese phosphorous trisulphide (MnPS3)

    International Journal of Hydrogen Energy, Vol. 43, Núm. 11, pp. 5903-5912

2016

  1. Computing force field-based directional maps in subquadratic time

    Knowledge-Based Systems, Vol. 95, pp. 58-70