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Chemically Assisted Precompression of Hydrogen Molecules in Alkaline-Earth Tetrahydrides.
Peña-Alvarez M, Binns J, Marqués M, Kuzovnikov MA, Dalladay-Simpson P, Pickard CJ, Ackland GJ, Gregoryanz E, Howie RT. Peña-Alvarez M, et al. Among authors: pickard cj. J Phys Chem Lett. 2022 Sep 15;13(36):8447-8454. doi: 10.1021/acs.jpclett.2c02157. Epub 2022 Sep 2. J Phys Chem Lett. 2022. PMID: 36053162 Free PMC article.
Structure and Metallicity of Phase V of Hydrogen.
Monserrat B, Drummond ND, Dalladay-Simpson P, Howie RT, López Ríos P, Gregoryanz E, Pickard CJ, Needs RJ. Monserrat B, et al. Among authors: pickard cj. Phys Rev Lett. 2018 Jun 22;120(25):255701. doi: 10.1103/PhysRevLett.120.255701. Phys Rev Lett. 2018. PMID: 29979086 Free article.
Superconducting Zirconium Polyhydrides at Moderate Pressures.
Xie H, Zhang W, Duan D, Huang X, Huang Y, Song H, Feng X, Yao Y, Pickard CJ, Cui T. Xie H, et al. Among authors: pickard cj. J Phys Chem Lett. 2020 Feb 6;11(3):646-651. doi: 10.1021/acs.jpclett.9b03632. Epub 2020 Jan 10. J Phys Chem Lett. 2020. PMID: 31903761
Synthesis of Weaire-Phelan Barium Polyhydride.
Peña-Alvarez M, Binns J, Martinez-Canales M, Monserrat B, Ackland GJ, Dalladay-Simpson P, Howie RT, Pickard CJ, Gregoryanz E. Peña-Alvarez M, et al. Among authors: pickard cj. J Phys Chem Lett. 2021 May 27;12(20):4910-4916. doi: 10.1021/acs.jpclett.1c00826. Epub 2021 May 19. J Phys Chem Lett. 2021. PMID: 34008402
High-temperature phase transitions in dense germanium.
Kelsall LC, Peña-Alvarez M, Martinez-Canales M, Binns J, Pickard CJ, Dalladay-Simpson P, Howie RT, Gregoryanz E. Kelsall LC, et al. Among authors: pickard cj. J Chem Phys. 2021 May 7;154(17):174702. doi: 10.1063/5.0047359. J Chem Phys. 2021. PMID: 34241079
183 results