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Authors whose works are in public domain in at least one jurisdiction

List of works by Yachao Zhang

3d-4f magnetic interaction with density functional theory plus u approach: local Coulomb correlation and exchange pathways.

scientific article published on 2 December 2013

Calculating spin crossover temperatures by a first-principles LDA+U scheme with parameter U evaluated from GW

scientific article published on 01 October 2019

Driving spin transition at interface: Role of adsorption configurations.

scientific article published in January 2018

Electric-field control of spin orientation of manganocene: An insight into molecule-substrate interactions

scientific article published on 01 January 2019

Extension of CAVS coarse-grained model to phospholipid membranes: The importance of electrostatics.

scientific article published on 7 March 2017

Intra- and Interatomic Spin Interactions by the Density Functional Theory plus U Approach: A Critical Assessment.

scientific article published on 15 August 2011

Molecular spin on surface: From strong correlation to dispersion interactions

scientific article published on 01 September 2016

Predicting critical temperatures of iron(II) spin crossover materials: density functional theory plus U approach

scientific article published on 01 December 2014

Single-molecule spin orientation control by an electric field.

scientific article published in May 2017

Surface effects on temperature-driven spin crossover in Fe(phen)2(NCS)2

scientific article published on 01 October 2020

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