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Home > Publications > Scientific Articles > 2018


  1. 51- Metal cluster electrides: a new type of molecular electride with delocalised polyattractor character.

    El Bakouri O, Postils V, Garcia-Borras M, Duran M, Luis JM, Calvello S, Soncini A, Matito E, Feixas F, Sola M.

    Chemistry A European Journal 24, 9853 (2018).

  2. 52- Ion-pair S(N)2 reaction of OH- and CH3Cl: activation strain analyses of counterion and solvent effects.

    Laloo JZA, Rhyman L, Larranaga O, Ramasami P, Bickelhaupt FM, and de Cozar A.

    Chemistry an Asian Journal 13, 1138 (2018).

  3. 53- Synthesis, crystal and topological electronic structures of new bismuth tellurohalides Bi2TeBr and Bi3TeBr.

    Zeugner A, Teichert J, Kaiser M, Menshchikova TV, Rusinov IP, Markelov AV, Chulkov EV, Doert T, Ruck M, and Isaeva A.

    Chemistry of Materials 30, 5272 (2018).

  4. 54- Sulfenamides as building blocks for efficient disulfide-based self-healing materials. A quantum chemical study.

    Ruiperez F, Galdeano M, Gimenez E, and Matxain JM.

    Chemistryopen 7, 248 (2018).

  5. 55- Magnesium bonds: from divalent Mg centres to trigonal and tetrahedral coordination.

    Grabowski SJ.

    Chemistryselect 3, 3147 (2018).

  6. 56- Coordination of Be and Mg centres by HCN ligands - Be...N and Mg...N interactions.

    Grabowski, SJ.

    CHEMPHYSCHEM 19, 1830 (2018).

  7. 57- Potential use of squarates and croconates as singlet fission sensitizers.

    Lopez-Carballeira D, Casanova D, and Ruiperez F.

    CHEMPHYSCHEM 19, 2224 (2018).

  8. 58- TCNQ physisorption on the topological insulator Bi2Se3.

    Della Pia A, Lisi S, De Luca O, Warr DA, Lawrence J, Otrokov MM, Aliev ZS, Chulkov EV, Agostino RG, Arnau A, Papagno M, and Costantini G.

    Chemphyschem 19, 2405 (2018).

  9. 59- Reversible two-state folding of the ultrafast protein gpW under mechanical force.

    Schonfelder J, De Sancho D, Berkovich R, Best RB, Munoz V, and Perez-Jimenez R.

    Communications Chemistry 1, UNSP 59 (2018).

  10. 60- Orbital-selective spin excitation of a magnetic porphyrin.

    Rubio-Verdu C, Sarasola A, Choi DJ, Majzik Z, Ebeling R, Calvo MR, Ugeda MM, Garcia-Lekue A, and Sanchez-Portal D, and Pascual JI.

    Communications Physics 1, UNSP 15 (2018).

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