Pere Alemany
Pere Alemany
Подтвержден адрес электронной почты в домене ub.edu
Название
Процитировано
Процитировано
Год
Broken symmetry approach to calculation of exchange coupling constants for homobinuclear and heterobinuclear transition metal complexes
E Ruiz, J Cano, S Alvarez, P Alemany
Journal of computational chemistry 20 (13), 1391-1400, 1999
9031999
Toward the prediction of magnetic coupling in molecular systems: hydroxo-and alkoxo-bridged Cu (II) binuclear complexes
E Ruiz, P Alemany, S Alvarez, J Cano
Journal of the American Chemical Society 119 (6), 1297-1303, 1997
8911997
Shape maps and polyhedral interconversion paths in transition metal chemistry
S Alvarez, P Alemany, D Casanova, J Cirera, M Llunell, D Avnir
Coordination chemistry reviews 249 (17-18), 1693-1708, 2005
7412005
Magnetic coupling in end-on azido-bridged transition metal complexes: A density functional study
E Ruiz, J Cano, S Alvarez, P Alemany
Journal of the American Chemical Society 120 (43), 11122-11129, 1998
7281998
The rich stereochemistry of eight‐vertex polyhedra: a continuous shape measures study
D Casanova, M Llunell, P Alemany, S Alvarez
Chemistry–A European Journal 11 (5), 1479-1494, 2005
5272005
SHAPE, version 2.1
M Llunell, D Casanova, J Cirera, P Alemany, S Alvarez
Universitat de Barcelona, Barcelona, Spain 2103, 2013
4882013
About the calculation of exchange coupling constants in polynuclear transition metal complexes
E Ruiz, A Rodríguez‐Fortea, J Cano, S Alvarez, P Alemany
Journal of computational chemistry 24 (8), 982-989, 2003
4712003
Structural modeling and magneto− structural correlations for hydroxo-bridged copper (II) binuclear complexes
E Ruiz, P Alemany, S Alvarez, J Cano
Inorganic chemistry 36 (17), 3683-3688, 1997
4491997
Exchange Coupling in Carboxylato‐Bridged Dinuclear Copper(II) Compounds: A Density Functional Study
A Rodríguez‐Fortea, P Alemany, S Alvarez, E Ruiz
Chemistry–A European Journal 7 (3), 627-637, 2001
3172001
Minimal distortion pathways in polyhedral rearrangements
D Casanova, J Cirera, M Llunell, P Alemany, D Avnir, S Alvarez
Journal of the American Chemical Society 126 (6), 1755-1763, 2004
3032004
Distortions in Octahedrally Coordinated d0 Transition Metal Oxides:  A Continuous Symmetry Measures Approach
KM Ok, PS Halasyamani, D Casanova, M Llunell, P Alemany, S Alvarez
Chemistry of materials 18 (14), 3176-3183, 2006
2822006
Exchange Coupling in Oxalato‐Bridged Copper(II) Binuclear Compounds: A Density Functional Study
J Cano, P Alemany, S Alvarez, M Verdaguer, E Ruiz
Chemistry–A European Journal 4 (3), 476-484, 1998
2121998
Local Aromaticity of [n]Acenes, [n]Phenacenes, and [n]Helicenes (n = 1−9)
G Portella, J Poater, JM Bofill, P Alemany, M Sola
The Journal of organic chemistry 70 (7), 2509-2521, 2005
2032005
Shape and Symmetry of Heptacoordinate Transition‐Metal Complexes: Structural Trends
D Casanova, P Alemany, JM Bofill, S Alvarez
Chemistry–A European Journal 9 (6), 1281-1295, 2003
1902003
Electronic structure and properties of AlN
E Ruiz, S Alvarez, P Alemany
Physical Review B 49 (11), 7115, 1994
1831994
Mapping the Stereochemistry and Symmetry of Tetracoordinate Transition‐Metal Complexes
J Cirera, P Alemany, S Alvarez
Chemistry–A European Journal 10 (1), 190-207, 2004
1742004
Electronic structure and properties of Cu 2 O
E Ruiz, S Alvarez, P Alemany, RA Evarestov
Physical Review B 56 (12), 7189, 1997
1701997
SHAPE v. 2.1
M Llunell, D Casanova, J Cirera, JM Bofill, P Alemany, S Alvarez, ...
University of Barcelona: Barcelona, Spain, 2013
1622013
Calculation of exchange coupling constants in solid state transition metal compounds using localized atomic orbital basis sets
E Ruiz, M Llunell, P Alemany
Journal of Solid State Chemistry 176 (2), 400-411, 2003
1502003
Shape
M Llunell, D Casanova, J Cirera, P Alemany, S Alvarez
Continuous Shape Measures Calculation, 2013
1462013
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Статьи 1–20