%0 Journal Article %1 RN50 %A Rodriguez-Castillo, M. %A Monge, M. %A Lopez-De-Luzuriaga, J.M. %A Olmos, M.E. %A Laguna, A. %A Mendizabal, F. %D 2011 %I 2011 Elsevier B.V. %J Computational and Theoretical Chemistry %K ab-initio, aggregation behavior, chemistry, copper(i), dqcauchile gold(i), gold, interaction, interactions, metallophilic vapochromic %N 1 %P 163-167 %R 10.1016/j.comptc.2011.01.040 %T Theoretical Study of the Closed-Shell D(10)-D(10) Au(I)-Cu(I) Attraction in Complexes in Extended Unsupported Chains %U /brokenurl#<Go to ISI>://WOS:000289496300021 %V 965 %X Model compounds are used to study the metallophilic attraction between gold and copper atoms. Ab initio calculations on dimers and tetramers in different distributions of the simplified units are analyzed. An attraction is found for all models and there is a reasonable agreement between the experimental and theoretical geometries.

@article{RN50, abstract = {Model compounds are used to study the metallophilic attraction between gold and copper atoms. Ab initio calculations on dimers and tetramers in different distributions of the simplified units are analyzed. An attraction is found for all models and there is a reasonable agreement between the experimental and theoretical geometries. }, added-at = {2019-12-04T03:57:35.000+0100}, author = {Rodriguez-Castillo, M. and Monge, M. and Lopez-De-Luzuriaga, J.M. and Olmos, M.E. and Laguna, A. and Mendizabal, F.}, biburl = {https://www.bibsonomy.org/bibtex/288f7534bc04c99b9b0d60f995fea16f3/dqcauchile}, doi = {10.1016/j.comptc.2011.01.040}, interhash = {0221e05baeeb00ad51c8b8abf436ccc2}, intrahash = {88f7534bc04c99b9b0d60f995fea16f3}, issn = {2210-271x}, journal = {Computational and Theoretical Chemistry}, keywords = {ab-initio, aggregation behavior, chemistry, copper(i), dqcauchile gold(i), gold, interaction, interactions, metallophilic vapochromic}, number = 1, pages = {163-167}, publisher = {2011 Elsevier B.V.}, timestamp = {2019-12-04T03:58:17.000+0100}, title = {Theoretical Study of the Closed-Shell D(10)-D(10) Au(I)-Cu(I) Attraction in Complexes in Extended Unsupported Chains}, type = {Journal Article}, url = {/brokenurl#<Go to ISI>://WOS:000289496300021}, volume = 965, year = 2011 }