List of 1st Posts (2020)

  1. Determining the Optimal Crystal Structure of Pd using DFT Energy Optimization Techniques by Andrew Wong
  2. Predict Zr lattice parameter for hcp structure α-zirconium by Yingdong Guan
  3. Determination of preferred crystal structure of Platinum and comparison with experimental observation. by Vishal Jindal
  4. Prediction of Au lattice constant in SC, FCC and HCP crystal structures using DFT calculation by Lingjie Zhou
  5. Preferred crystal structure and lattice parameter of Ru (simple cubic, fcc, or hcp) by fxz67
  6. The optimization of lattice constants of bulk hexagonal boron nitride (hBN) by Da Zhou
  7. DFT Optimization of Ag in sc, fcc, and hcp Geometries by Jeremy Hu
  8. Optimal lattice parameter determination of Fe bcc structure using the generalized gradient approximations with PBE and PW91 functionals by Aditya Lele
  9. Geometry Optimization of an Ag Crystal using CASTEP by njk22
  10. Lattice Structure for Lithium by mzp523
  11. Prediction of preferred structure and lattice parameters of Rh by Gaohe Hu
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