Search research articles
Contact Us
Filters
Showing results (1-10 of 16) with videos related to
Page
of 2
Sort By:
The Journal of Chemical Physics
|
September 16, 2024
A prediction of high temperature magnetic coupling in transition metal phthalocyanines
James Broadhurst, Giuseppe Mallia, Nicholas Harrison
The Journal of Chemical Physics
|
June 25, 2025
The quantum origin of magnetic coupling in molecular crystals for spintronics
James Broadhurst, Giuseppe Mallia, Nicholas Harrison
The Journal of Physical Chemistry. C, Nanomaterials and Interfaces
|
November 25, 2022
Strain-Tuneable Magnetism and Spintronics of Distorted Monovacancies in Graphene
Huanyu Zhou, Giuseppe Mallia, Nicholas M Harrison
Materials Horizons
|
May 14, 2025
<i>Ab initio</i> simulation of molecular crystal regrowth of paracetamol from solution
Huanyu Zhou, Giuseppe Mallia, Nicholas M Harrison
Journal of Chemical Theory and Computation
|
October 1, 2025
Influences of Basis Set and Electronic Exchange-Correlation on Low-Frequency Vibrations and Stability of Paracetamol Polymorphs
Huanyu Zhou, Giuseppe Mallia, Nicholas M Harrison
Chemical Communications (Cambridge, England)
|
March 11, 2011
An alternative approach for the calculation of correlation energy in periodic systems: a hybrid MP2(B3LYP) study of the He-MgO(100) interaction
Ruth Martinez-Casado, Giuseppe Mallia, Nicholas M Harrison
Journal of Computational Chemistry
|
June 27, 2003
Implementation of the finite field perturbation method in the CRYSTAL program for calculating the dielectric constant of periodic systems
Clovis Darrigan, Michel Rérat, Giuseppe Mallia, et al.
Chemical Communications (Cambridge, England)
|
September 29, 2011
Ab initio calculation of the MgO(100) interaction with He and Ne: a HF + MP2 and HF + MP2(B3LYP) comparison
Ruth Martinez-Casado, Giuseppe Mallia, Nicholas M Harrison
ACS Omega
|
March 14, 2022
Monomolecular Cracking of Propane: Effect of Zeolite Confinement and Acidity
Zainab A Alaithan, Giuseppe Mallia, Nicholas M Harrison
The Journal of Physical Chemistry Letters
|
March 21, 2018
Unravelling Some of the Structure-Property Relationships in Graphene Oxide at Low Degree of Oxidation
Filippo Savazzi, Francesca Risplendi, Giuseppe Mallia, et al.
Page
of 2
Search research articles
Search
Showing results (1-10 of 16) with videos related to
Sort By:
Page
of 2
The Journal of Chemical Physics
|
September 16, 2024
A prediction of high temperature magnetic coupling in transition metal phthalocyanines
James Broadhurst, Giuseppe Mallia, Nicholas Harrison
The Journal of Chemical Physics
|
June 25, 2025
The quantum origin of magnetic coupling in molecular crystals for spintronics
James Broadhurst, Giuseppe Mallia, Nicholas Harrison
The Journal of Physical Chemistry. C, Nanomaterials and Interfaces
|
November 25, 2022
Strain-Tuneable Magnetism and Spintronics of Distorted Monovacancies in Graphene
Huanyu Zhou, Giuseppe Mallia, Nicholas M Harrison
Materials Horizons
|
May 14, 2025
<i>Ab initio</i> simulation of molecular crystal regrowth of paracetamol from solution
Huanyu Zhou, Giuseppe Mallia, Nicholas M Harrison
Journal of Chemical Theory and Computation
|
October 1, 2025
Influences of Basis Set and Electronic Exchange-Correlation on Low-Frequency Vibrations and Stability of Paracetamol Polymorphs
Huanyu Zhou, Giuseppe Mallia, Nicholas M Harrison
Chemical Communications (Cambridge, England)
|
March 11, 2011
An alternative approach for the calculation of correlation energy in periodic systems: a hybrid MP2(B3LYP) study of the He-MgO(100) interaction
Ruth Martinez-Casado, Giuseppe Mallia, Nicholas M Harrison
Journal of Computational Chemistry
|
June 27, 2003
Implementation of the finite field perturbation method in the CRYSTAL program for calculating the dielectric constant of periodic systems
Clovis Darrigan, Michel Rérat, Giuseppe Mallia, et al.
Chemical Communications (Cambridge, England)
|
September 29, 2011
Ab initio calculation of the MgO(100) interaction with He and Ne: a HF + MP2 and HF + MP2(B3LYP) comparison
Ruth Martinez-Casado, Giuseppe Mallia, Nicholas M Harrison
ACS Omega
|
March 14, 2022
Monomolecular Cracking of Propane: Effect of Zeolite Confinement and Acidity
Zainab A Alaithan, Giuseppe Mallia, Nicholas M Harrison
The Journal of Physical Chemistry Letters
|
March 21, 2018
Unravelling Some of the Structure-Property Relationships in Graphene Oxide at Low Degree of Oxidation
Filippo Savazzi, Francesca Risplendi, Giuseppe Mallia, et al.
Page
of 2