List of works - Shoutao Zhang

ATLAS: A real-space finite-difference implementation of orbital-free density functional theory ⬇️

Achieving high hydrogen evolution reaction activity of a Mo2C monolayer

scientific article published on 16 November 2020

Coexistence of superconductivity and electride states in Ca<sub>2</sub>H with an antifluorite-type motif under compression

scientific article published in January 2023

Emerging Yttrium Phosphides with Tetrahedron Phosphorus and Superconductivity under High Pressures

scientific article published on 22 October 2021

First-principle optimal local pseudopotentials construction via optimized effective potential method

scientific article published on 01 April 2016

Globally stable structures of LixZn (x = 1-4) compounds at high pressures.

scientific article published on 21 January 2016

Gold with +4 and +6 Oxidation States in AuF4 and AuF6

scientific article published on 23 July 2018

High-Temperature Ferromagnetism in an Fe3P Monolayer with a Large Magnetic Anisotropy

scientific article published on 13 May 2019

Hypervalent Iodine with Linear Chain at High Pressure.

scientific article published on 24 September 2015

Phase Diagram and High-Temperature Superconductivity of Compressed Selenium Hydrides

scientific article

Predicted Pressure-Induced Superconducting Transition in Electride Li_{6}P

scientific article published on 01 March 2019

Pressure-Induced Stable Beryllium Peroxide.

scientific article

Silicon Framework-Based Lithium Silicides at High Pressures

scientific article published on 24 June 2016

Structure and Electronic Properties of Fe2SH3 Compound under High Pressure

scientific article published on 26 October 2016

Superconductive Sodium Carbides with Pentagon Carbon at High Pressures

scientific article published on 17 June 2021

Tellurium Hydrides at High Pressures: High-Temperature Superconductors

scientific article published on 4 February 2016

TiC3 Monolayer with High Specific Capacity for Sodium-Ion Batteries.

scientific article

Two-Dimensional PC6 with Direct Band Gap and Anisotropic Carrier Mobility

scientific article published on 16 January 2019

Unconventional stable stoichiometry of vanadium peroxide

scientific article published on 11 May 2020

List of works by Shoutao Zhang

ATLAS: A real-space finite-difference implementation of orbital-free density functional theory ⬇️

Achieving high hydrogen evolution reaction activity of a Mo2C monolayer

Coexistence of superconductivity and electride states in Ca<sub>2</sub>H with an antifluorite-type motif under compression

Emerging Yttrium Phosphides with Tetrahedron Phosphorus and Superconductivity under High Pressures

First-principle optimal local pseudopotentials construction via optimized effective potential method

Globally stable structures of LixZn (x = 1-4) compounds at high pressures.

Gold with +4 and +6 Oxidation States in AuF4 and AuF6

High-Temperature Ferromagnetism in an Fe3P Monolayer with a Large Magnetic Anisotropy

Hypervalent Iodine with Linear Chain at High Pressure.

Phase Diagram and High-Temperature Superconductivity of Compressed Selenium Hydrides

Predicted Pressure-Induced Superconducting Transition in Electride Li_{6}P

Pressure-Induced Stable Beryllium Peroxide.

Silicon Framework-Based Lithium Silicides at High Pressures

Structure and Electronic Properties of Fe2SH3 Compound under High Pressure

Superconductive Sodium Carbides with Pentagon Carbon at High Pressures

Tellurium Hydrides at High Pressures: High-Temperature Superconductors

TiC3 Monolayer with High Specific Capacity for Sodium-Ion Batteries.

Two-Dimensional PC6 with Direct Band Gap and Anisotropic Carrier Mobility

Unconventional stable stoichiometry of vanadium peroxide