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Chemistry (Weinheim an Der Bergstrasse, Germany)
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March 16, 2010
Study of the light-induced spin crossover process of the [Fe(II)(bpy)3]2+ complex
Coen de Graaf, Carmen Sousa
Physical Chemistry Chemical Physics : PCCP
|
December 15, 2015
TD-DFT study of the light-induced spin crossover of Fe(III) complexes
Sergi Saureu, Coen de Graaf
Dalton Transactions (Cambridge, England : 2003)
|
November 1, 2014
The effect of thermal motion on the electron localization in metal-to-ligand charge transfer excitations in [Fe(bpy)3](2+)
Alex Domingo, Carmen Sousa, Coen de Graaf
Physical Chemistry Chemical Physics : PCCP
|
October 10, 2013
Theoretical determination of spin Hamiltonians with isotropic and anisotropic magnetic interactions in transition metal and lanthanide complexes
Rémi Maurice, Coen de Graaf, Nathalie Guihéry
Dalton Transactions (Cambridge, England : 2003)
|
November 2, 2011
Towards a low-spin configuration in extended metal atom chains. Theoretical study of trimetallic systems with 22 metal electrons
Zahra Tabookht, Coen de Graaf, Xavier López
The Journal of Physical Chemistry. A
|
June 25, 2010
Extraction of magnetic coupling parameters in 2-dimensional magnetic honeycomb layers
Igor Negodaev, Coen de Graaf, Rosa Caballol
The Journal of Chemical Physics
|
September 7, 2010
Magnetostructural relations from a combined ab initio and ligand field analysis for the nonintuitive zero-field splitting in Mn(III) complexes
Rémi Maurice, Coen de Graaf, Nathalie Guihéry
The Journal of Physical Chemistry. A
|
February 1, 2019
Trends in the Bond Multiplicity of Cr<sub>2</sub>, Cr<sub>3</sub>, and Cr<sub>2</sub>M (M = Zn, Ni, Fe, Mn) Complexes Extracted from Multiconfigurational Wave Functions
Mariano Spivak, Xavier López, Coen de Graaf
The Journal of Physical Chemistry. A
|
January 7, 2010
Analysis of the magnetic coupling in M3(dpa)4Cl2 systems (M = Ni, Pd, Cu, Ag) by ab initio calculations
Zahra Tabookht, Xavier López, Coen de Graaf
The Journal of Chemical Physics
|
April 14, 2007
Role of charge transfer configurations in LaMnO3, CaMnO3, and CaFeO3
Aymeric Sadoc, Ria Broer, Coen de Graaf
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Search research articles
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Showing results (1-10 of 79) with videos related to
Sort By:
Page
of 8
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
March 16, 2010
Study of the light-induced spin crossover process of the [Fe(II)(bpy)3]2+ complex
Coen de Graaf, Carmen Sousa
Physical Chemistry Chemical Physics : PCCP
|
December 15, 2015
TD-DFT study of the light-induced spin crossover of Fe(III) complexes
Sergi Saureu, Coen de Graaf
Dalton Transactions (Cambridge, England : 2003)
|
November 1, 2014
The effect of thermal motion on the electron localization in metal-to-ligand charge transfer excitations in [Fe(bpy)3](2+)
Alex Domingo, Carmen Sousa, Coen de Graaf
Physical Chemistry Chemical Physics : PCCP
|
October 10, 2013
Theoretical determination of spin Hamiltonians with isotropic and anisotropic magnetic interactions in transition metal and lanthanide complexes
Rémi Maurice, Coen de Graaf, Nathalie Guihéry
Dalton Transactions (Cambridge, England : 2003)
|
November 2, 2011
Towards a low-spin configuration in extended metal atom chains. Theoretical study of trimetallic systems with 22 metal electrons
Zahra Tabookht, Coen de Graaf, Xavier López
The Journal of Physical Chemistry. A
|
June 25, 2010
Extraction of magnetic coupling parameters in 2-dimensional magnetic honeycomb layers
Igor Negodaev, Coen de Graaf, Rosa Caballol
The Journal of Chemical Physics
|
September 7, 2010
Magnetostructural relations from a combined ab initio and ligand field analysis for the nonintuitive zero-field splitting in Mn(III) complexes
Rémi Maurice, Coen de Graaf, Nathalie Guihéry
The Journal of Physical Chemistry. A
|
February 1, 2019
Trends in the Bond Multiplicity of Cr<sub>2</sub>, Cr<sub>3</sub>, and Cr<sub>2</sub>M (M = Zn, Ni, Fe, Mn) Complexes Extracted from Multiconfigurational Wave Functions
Mariano Spivak, Xavier López, Coen de Graaf
The Journal of Physical Chemistry. A
|
January 7, 2010
Analysis of the magnetic coupling in M3(dpa)4Cl2 systems (M = Ni, Pd, Cu, Ag) by ab initio calculations
Zahra Tabookht, Xavier López, Coen de Graaf
The Journal of Chemical Physics
|
April 14, 2007
Role of charge transfer configurations in LaMnO3, CaMnO3, and CaFeO3
Aymeric Sadoc, Ria Broer, Coen de Graaf
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