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Determination of Local Spins by Means of a Spin-Free Treatment

Journal of chemical theory and computation, 2011-11, Vol.7 (11), p.3560-3566

2011

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Local spin: A treatment beyond single determinant wave functions

Chemical physics letters, 2009-02, Vol.470 (1), p.136-139

2009

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Analysis of Local and Global Aromaticity in Si3C5 and Si4C8 Clusters. Aromatic Species Containing Planar Tetracoordinate Carbon

Chemistry an international journal, 2021-12, Vol.3 (4), p.1101-1112

2021

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AmI and deployment considerations in AAL services provision for elderly independent living: the MonAMI project

Sensors (Basel, Switzerland), 2013-07, Vol.13 (7), p.8950-8976

2013

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The Son Poc rockfall (Mallorca, Spain) on the 6th of March 2013: 3D simulation

Landslides, 2014-06, Vol.11 (3), p.493-503

2014

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Energy decompositions according to physical space partitioning schemes

The Journal of chemical physics, 2005-02, Vol.122 (7), p.074102-074102

2005

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MonAMI: Mainstream on ambient intelligence. e-inclusion living scaled field trial experience in Spain

Journal of research and practice in information technology, 2013-05, Vol.45 (2), p.133-149

2013

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Generalized spin σ -SCF method

The Journal of chemical physics, 2023-12, Vol.159 (21)

2023

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Determination of electronic excitation energies within the doubly occupied configuration interaction space by means of the Hermitian operator method

The Journal of chemical physics, 2023-09, Vol.159 (12)

2023

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Studies of molecular dissociation by means of restricted and unrestricted treatments within the doubly occupied configuration interaction framework

International journal of quantum chemistry, 2023-07, Vol.123 (14), p.n/a

2023

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Attaining the maximum Bose–Einstein condensation in a finite-size hard-core boson model

Journal of physics. A, Mathematical and theoretical, 2024-01, Vol.57 (1), p.15301

2024

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Influence of the N-representability conditions on the variational determination of two-electron reduced density matrices for ground and excited N-electron states in the doubly occupied configuration interaction space

The Journal of chemical physics, 2022-11, Vol.157 (20), p.204103-204103

2022

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Variational determination of the two-electron reduced density matrix within the doubly occupied configuration interaction framework: Treatments of triplet N-electron systems

The Journal of chemical physics, 2022-07, Vol.157 (1), p.014102-014102

2022

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Variational Optimization of the Second-Order Density Matrix Corresponding to a Seniority-Zero Configuration Interaction Wave Function

Journal of chemical theory and computation, 2015-09, Vol.11 (9), p.4064-4076

2015

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Configuration interaction wave functions: a seniority number approach

The Journal of chemical physics, 2014-06, Vol.140 (23), p.234103-234103

2014

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Direct variational determination of the two-electron reduced density matrix for doubly occupied-configuration-interaction wave functions: The influence of three-index N-representability conditions

The Journal of chemical physics, 2018-01, Vol.148 (2), p.024105-024105

2018

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Unrestricted treatment for the direct variational determination of the two-electron reduced density matrix for doubly occupied-configuration-interaction wave functions

The Journal of chemical physics, 2019-04, Vol.150 (16), p.164106-164106

2019

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Variational determination of the two-electron reduced density matrix within the doubly occupied configuration interaction scheme: An extension to the study of open-shell systems

The Journal of chemical physics, 2020-08, Vol.153 (8), p.084101-084101

2020

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Variational reduced density matrix method in the doubly occupied configuration interaction space using three-particle N-representability conditions

The Journal of chemical physics, 2018-11, Vol.149 (19), p.194105-194105

2018

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A quantum-chemical study of boro-fullerenes B60H60, B60F30H30, and B60F60

Computational and theoretical chemistry, 2023-02, Vol.1220, p.113987, Article 113987

2023

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Variational determination of ground and excited-state two-electron reduced density matrices in the doubly occupied configuration space: A dispersion operator approach

The Journal of chemical physics, 2021-06, Vol.154 (22), p.224104-224104

2021

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Exploiting the nearsightedness principle within the framework of the anti‐Hermitian contracted Schrödinger equation

International journal of quantum chemistry, 2022-03, Vol.122 (6), p.n/a

2022

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A hybrid configuration interaction treatment based on seniority number and excitation schemes

The Journal of chemical physics, 2014-12, Vol.141 (24), p.244118-244118

2014

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Seniority number in spin-adapted spaces and compactness of configuration interaction wave functions

The Journal of chemical physics, 2013-08, Vol.139 (8), p.084103-084103

2013

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Large scale rockfall reach susceptibility maps in La Cabrera Sierra (Madrid) performed with GIS and dynamic analysis at 1:5,000

Natural hazards (Dordrecht), 2003-11, Vol.30 (3), p.325-340

2003

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Determination of Local Spins by Means of a Spin-Free Treatment

Local spin: A treatment beyond single determinant wave functions

Analysis of Local and Global Aromaticity in Si3C5 and Si4C8 Clusters. Aromatic Species Containing Planar Tetracoordinate Carbon

AmI and deployment considerations in AAL services provision for elderly independent living: the MonAMI project

The Son Poc rockfall (Mallorca, Spain) on the 6th of March 2013: 3D simulation

Energy decompositions according to physical space partitioning schemes

MonAMI: Mainstream on ambient intelligence. e-inclusion living scaled field trial experience in Spain

Generalized spin σ -SCF method

Determination of electronic excitation energies within the doubly occupied configuration interaction space by means of the Hermitian operator method

Studies of molecular dissociation by means of restricted and unrestricted treatments within the doubly occupied configuration interaction framework

Attaining the maximum Bose–Einstein condensation in a finite-size hard-core boson model

Influence of the N-representability conditions on the variational determination of two-electron reduced density matrices for ground and excited N-electron states in the doubly occupied configuration interaction space

Variational determination of the two-electron reduced density matrix within the doubly occupied configuration interaction framework: Treatments of triplet N-electron systems

Variational Optimization of the Second-Order Density Matrix Corresponding to a Seniority-Zero Configuration Interaction Wave Function

Configuration interaction wave functions: a seniority number approach

Direct variational determination of the two-electron reduced density matrix for doubly occupied-configuration-interaction wave functions: The influence of three-index N-representability conditions

Unrestricted treatment for the direct variational determination of the two-electron reduced density matrix for doubly occupied-configuration-interaction wave functions

Variational determination of the two-electron reduced density matrix within the doubly occupied configuration interaction scheme: An extension to the study of open-shell systems

Variational reduced density matrix method in the doubly occupied configuration interaction space using three-particle N-representability conditions

A quantum-chemical study of boro-fullerenes B60H60, B60F30H30, and B60F60

Variational determination of ground and excited-state two-electron reduced density matrices in the doubly occupied configuration space: A dispersion operator approach

Exploiting the nearsightedness principle within the framework of the anti‐Hermitian contracted Schrödinger equation

A hybrid configuration interaction treatment based on seniority number and excitation schemes

Seniority number in spin-adapted spaces and compactness of configuration interaction wave functions

Large scale rockfall reach susceptibility maps in La Cabrera Sierra (Madrid) performed with GIS and dynamic analysis at 1:5,000

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