Browsing by Subject Crystallography

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Issue DateTitleAuthor(s)
2004[1,9-bid(3,5-dimethylpyrazol-1-yl-kn2)-3,7-dithianonane-k2S,S']palladium(II)bis(tetrafluoroborate)García-Antón, J.; Pons, Josefina; Ros, Josep; Solans, Xavier, 1949-2007; Font Bardia, Ma. Mercedes
20041.48 and 1.84 µm thulium emissions in monoclinic KGd(WO4)2 single crystalsGüell Vilà, Frank; Gavaldà, Josefina; Solé i Cartañá, Rosa Ma.; Aguiló Díaz, Magdalena; Díaz, Francesc (Díaz González); Galan, M.; Massons, Jaume
20071.84 micron emission of Tm3+ sensitized by Yb3+ ions in monoclinic KGd(WO4)2 single crystalsGüell Vilà, Frank; Massons, Jaume; Gavaldà, Josefina; Pujol Baigés, Maria Cinta; Aguiló Díaz, Magdalena; Díaz, Francesc (Díaz González)
19-Jan-2018A 2D rhomboidal system of manganese(II) [Mn(3-MeC6H4COO)2(H2O)2]n with spin canting: rationalization of the magnetic exchangeGarcia-Cirera, B.; Costa Sala, Ramon; Moreira, Ibério de Pinho Ribeiro; Font Bardia, Ma. Mercedes; Corbella i Cordomí, Montserrat
1-Dec-2025A Cartesian encoding graph neural network for crystal structure property prediction: application to thermal ellipsoid estimationSole Gomez, Jaume Alexandre; Mosella-Montoro, Albert; Cardona, Joan; Gómez Coca, Silvia; Aravena Ponce, Daniel Alejandro; Ruiz Sabín, Eliseo; Ruiz-Hidalgo, Javier
8-May-2017A combined crystallographic and theoretical study of weak intermolecular interactions in crystalline squaric acid esters and amidesProhens López, Rafael; Portell Bueso, Anna; Font Bardia, Ma. Mercedes; Bauzá, Antonio; Frontera, Antonio
2015A coumarin based gold(I)-alkynyl complex: a new Q1 class of supramolecular hydrogelatorsMoro, Artur J.; Rome, Bertrand; Aguiló Linares, Elisabet; Arcau, Julià; Puttreddy, Rakesh; Rissanen, Kari; Lima, João Carlos; Rodríguez Raurell, Laura
14-Oct-2020A heterometallic [LnLn ' Ln] lanthanide complex as a qubit with embedded quantum error correctionMacaluso, Emilio; Rubin, Marcos; Aguilà Avilés, David; Chiesa, Alessandro; Barrios Moreno, Leoní Alejandra; Martínez, Jesús I.; Alonso Gascón, Pablo Javier; Roubeau, Olivier; Luis Vitalla, Fernando; Aromí Bedmar, Guillem; Carretta, Stefano
20-Jun-2022A Hg(I) corrugated sheet assembled by auxiliary dioxole groups and Hg··· π interactionsSolans-Monfort, Xavier; Sánchez-Férez, Francisco; Calvet Pallàs, Maria Teresa; Font Bardia, Ma. Mercedes; Pons, Josefina
10-Jun-2014A new dinuclear copper(II) complex of unexpected formation with the 1-[2-(ethylamino)methyl]pyrazole ligand presents a curious Ferris wheel-like shape at supramolecular self-assemblyLópez Marzo, Adaris M.; Guerrero, Miguel; Calvet Pallàs, Maria Teresa; Font Bardia, Ma. Mercedes; Pons, Josefina
Aug-2019A novel type of organometallic 2-R-2,4-dihydro- 1H-3,1-benzoxazine with R = [M(η5-C5H4)(CO)3] (M = Re or Mn) units. Experimental and computational studies of the effect of substituent R on ring-chain tautomerismOyarzo, Juan; Bosque Pueyo, Ramón; Toro, Patricia; Silva, Carlos P.; Arancibia, Rodrigo; Font Bardia, Ma. Mercedes; Artigas, Vania; Calvis, Carme; Messeguer i Peypoch, Ramon; Klahn, A. Hugo; López, Concepción
3-Mar-2021A Novel, Extremely Bioavailable Cocrystal of PterostilbeneBofill, Lídia; Barbas Cañero, Rafael; Sande, Dafne de; Font Bardia, Ma. Mercedes; Ràfols Llach, Clara; Albertí, Joan; Prohens López, Rafael
22-Aug-2018A spin-crossover molecular material describing four distinct thermal pathwaysBartual-Murgui, Carlos; Diego, Rosa; Vela Llausí, Sergi; Teat, Simon J.; Roubeau, Olivier; Aromí Bedmar, Guillem
2009Ac conductance in granular insulating Co-ZrO2 thin films: A universal responseKonstantinović, Zorica; García del Muro y Solans, Montserrat; Kovylina, Miroslavna; Batlle Gelabert, Xavier; Labarta, Amílcar
3-Aug-2022Amide-Driven Secondary Building Unit Structural Transformations between Zn(II) Coordination PolymersEjarque, Daniel; Calvet Pallàs, Maria Teresa; Font Bardia, Ma. Mercedes; Pons, Josefina
17-Jan-2019An In-Depth Look at DNA Crystals through the Prism of Molecular Dynamics SimulationsKuzmanic, Antonija; Dans, Pablo D.; Orozco López, Modesto
23-Jun-2008Analysis of S-rich CuIn(S,Se)2 layers for photovoltaic applications: Influence of the sulfurization temperature on the crystalline properties of electrodeposited and sulfurized CuInSe2 precursorsIzquierdo Roca, Victor; Pérez Rodríguez, Alejandro; Morante i Lleonart, Joan Ramon; Álvarez García, Jacobo; Calvo Barrio, Lorenzo; Bermudez, V.; Grand, P. P.; Parissi, L.; Broussillon, C.; Kerrec, O.
2000Antiferromagnetic correlations in Fe-Cu granular alloys: the role of the surface structureBatlle Gelabert, Xavier; Echer, Chuck J.; Nelson, E. Chris; Krishnan, K. M.; Hattink, Bart Jan
2016Authentication of Iberian dry-cured ham: New approaches by polymorphic fingerprint and ultrahigh resolution mass spectrometryBayés-García, Laura; Tres Oliver, Alba; Vichi, S. (Stefania); Calvet Pallàs, Maria Teresa; Cuevas Diarte, Miguel Ángel; Codony Salcedo, Rafael; Boatella, J.; Caixach Gamisans, Josep; Ueno, S.; Guardiola Ibarz, Francesc
2008Ba3Yb(BO3)3 single crystals. Growth and spectroscopic characterizationSolé Vicente, Ricard, 1962-; Güell Vilà, Frank; Gavaldà, Josefina; Aguiló Díaz, Magdalena; Díaz, Francesc (Díaz González)