Počet záznamov: 1
Ab initio study of the stability of beryllium clusters: accurate calculations for Be2-6
Názov Ab initio study of the stability of beryllium clusters: accurate calculations for Be2-6 Autor Sulka M. Pitoňák Michal SAVVS ; SAVCSC - Výpočtové stredisko SAV Spoluautori Labanc D. Kovac M. Cernusak I. Neogrady P. Zdroj.dok. Journal of Physics B: Atomic, Molecular and Optical Physics. Vol. 45, no. 8 (2012), art. no. 085102 Jazyk dok. eng - angličtina Druh dok. rozpis článkov z periodík (rbx) Ohlasy MONTERO-CAMPILLO, M. Merced - MO, Otilia - YANEZ, Manuel - ALKORTA, Ibon - ELGUERO, Jose. The beryllium bond. In COMPUTATIONAL CHEMISTRY. ISSN 0898-8838, 2019, vol. 73, no., pp. 73-121. BATTAGLIA, Stefano - FAGINAS-LAGO, Noelia - LEININGER, Thierry - EVANGELISTI, Stefano. Tuning the magnetic properties of beryllium chains. In PHYSICAL CHEMISTRY CHEMICAL PHYSICS. ISSN 1463-9076, 2019, vol. 21, no. 11, pp. 6080-6086. ZDETSIS, Aristides D. - SIGALAS, Michael M. - KOUKARAS, Emmanuel N. Ab initio theoretical investigation of beryllium and beryllium hydride nanoparticles and nanocrystals with implications for the corresponding infinite systems. In PHYSICAL CHEMISTRY CHEMICAL PHYSICS. ISSN 1463-9076, 2014, vol. 16, no. 27, pp. 14172-14182. SHARIPOV, Alexander S. - LOUKHOVITSKI, Boris I. - STARIK, Alexander M. The influence of vibrations of polyatomic molecules on dipole moment and static dipole polarizability: theoretical study. In JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS. ISSN 0953-4075, 2017, vol. 50, no. 16, pp. EL BAKOURI, Ouissam - POSTILS, Veronica - GARCIA-BORRAS, Marc - DURAN, Miquel - LUIS, Josep M. - CALVELLO, Simone - SONCINI, Alessandro - MATITO, Eduard - FEIXAS, Ferran - SOLA, Miquel. Metal Cluster Electrides: A New Type of Molecular Electride with Delocalised Polyattractor Character. In CHEMISTRY-A EUROPEAN JOURNAL. ISSN 0947-6539, 2018, vol. 24, no. 39, pp. 9853-9859. XU, Liang - XU, Yuqing - CHEUNG, Nai-Ho - WONG, Kin-Yiu. Practical approach for beryllium atomic clusters: TD-DFT potential energy surfaces from equilibrium to dissociation for excited states of 2s> 2p. In THEORETICAL CHEMISTRY ACCOUNTS. ISSN 1432-881X, 2018, vol. 137, no. 10, pp. ZHOU, Junquan - BO, Maolin - LI, Lei - HUANG, Zhongkai - TIAN, Meizi - YAO, Chuang - PENG, Cheng. Bond-Energy-Electron Relaxation of Be-N Nanoclusters and BeX Alloys. In ADVANCED THEORY AND SIMULATIONS, 2018, vol. 1, no. 8, pp. FIORESSI, Silvina E. - DUCHOWICZ, Pablo - BACELO, Daniel E. DFT Study on the Structures and Stability of BenSnn (n=1-5) and Be2nSnn (n=1-4) Clusters. In CHEMISTRYSELECT. ISSN 2365-6549, 2018, vol. 3, no. 46, pp. 13017-13024. MONTERO-CAMPILLO, M. Merced - MO, Otilia - YANEZ, Manuel - ALKORTA, Ibon - ELGUERO, Jose. The beryllium bond. In COMPUTATIONAL CHEMISTRY, 2019, vol. 73, no., pp. 73-121. ISSN 0898-8838. Dostupné na: https://doi.org/10.1016/bs.adioch.2018.10.003. BATTAGLIA, Stefano - FAGINAS-LAGO, Noelia - LEININGER, Thierry - EVANGELISTI, Stefano. Tuning the magnetic properties of beryllium chains. In PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2019, vol. 21, no. 11, pp. 6080-6086. ISSN 1463-9076. Dostupné na: https://doi.org/10.1039/c8cp07159d. ABYAZ, B. - MAHDAVIFAR, Z. - SCHRECKENBACH, G. - GAO, Y. Prediction of beryllium clusters (Be-n; n=3-25) from first principles. In PHYSICAL CHEMISTRY CHEMICAL PHYSICS. ISSN 1463-9076, SEP 21 2021, vol. 23, no. 35, p. 19716-19728. Dostupné na: https://doi.org/10.1039/d1cp02513a. Kategória ADCA - Vedecké práce v zahraničných karentovaných časopisoch impaktovaných Kategória (od 2022) V3 - Vedecký výstup publikačnej činnosti z časopisu Typ výstupu článok Rok vykazovania 2012 Registrované v WOS Registrované v CCC DOI 10.1088/0953-4075/45/8/085102 
článok
rok CC IF IF Q (best) JCR Av Jour IF Perc SJR SJR Q (best) CiteScore A rok vydania rok metriky IF IF Q (best) SJR SJR Q (best) 2012 2011 1.875 Q2 1.061 Q1
Počet záznamov: 1