The D alton quantum chemistry program system K Aidas, C Angeli, KL Bak, V Bakken, R Bast, L Boman, O Christiansen, ... Wiley Interdisciplinary Reviews: Computational Molecular Science 4 (3), 269-284, 2014 | 1436 | 2014 |
Место установки программы:/opt/lib/dalton/Книги и статьи:• Aidas K., Angeli C., Bak KL The Dalton quantum chemistry program system.//Wires computational molecular science, 2014 … K Aidas science 4 (3), 269-284, 2014 | 233 | 2014 |
Why downfield proton chemical shifts are not reliable aromaticity indicators F Faglioni, A Ligabue, S Pelloni, A Soncini, RG Viglione, MB Ferraro, ... Organic Letters 7 (16), 3457-3460, 2005 | 93 | 2005 |
Current density maps, magnetizability, and nuclear magnetic shielding tensors for anthracene, phenanthrene, and triphenylene A Ligabue, U Pincelli, P Lazzeretti, R Zanasi Journal of the American Chemical Society 121 (23), 5513-5518, 1999 | 92 | 1999 |
Theoretical results which strengthen the hypothesis of electroweak bioenantioselection R Zanasi, P Lazzeretti, A Ligabue, A Soncini Physical Review E 59 (3), 3382, 1999 | 67 | 1999 |
Ring-current models from the differential Biot-Savart law S Pelloni, A Ligabue, P Lazzeretti Organic Letters 6 (24), 4451-4454, 2004 | 65 | 2004 |
Correlated and gauge invariant calculations of nuclear magnetic shielding constants using the continuous transformation of the origin of the current density approach A Ligabue, SPA Sauer, P Lazzeretti The Journal of chemical physics 118 (15), 6830-6845, 2003 | 58 | 2003 |
M.; de Merás K Aidas, C Angeli, KL Bak, V Bakken, R Bast, L Boman, O Christiansen, ... AS, 0 | 49 | |
Ring Currents and Magnetic Properties of s-Indacene, an Archetypal Paratropic, Non-Antiaromatic Molecule R Soriano Jartin, A Ligabue, A Soncini, P Lazzeretti The Journal of Physical Chemistry A 106 (48), 11806-11814, 2002 | 47 | 2002 |
Theoretical determination of parity-violating vibrational frequency differences between the enantiomers of the CHFClBr molecule RG Viglione, R Zanasi, P Lazzeretti, A Ligabue Physical Review A 62 (5), 052516, 2000 | 46 | 2000 |
Molecular response to a time-independent non-uniform magnetic-field F Faglioni, A Ligabue, S Pelloni, A Soncini, P Lazzeretti Chemical physics 304 (3), 289-299, 2004 | 39 | 2004 |
Gauge invariant calculations of nuclear magnetic shielding constants using the continuous transformation of the origin of the current density approach. II. Density functional … A Ligabue, S Sauer, P Lazzeretti The Journal of chemical physics 126 (15), 2007 | 38 | 2007 |
Ring current effects on nuclear magnetic shielding of carbon in the benzene molecule MB Ferraro, F Faglioni, A Ligabue, S Pelloni, P Lazzeretti Magnetic Resonance in Chemistry 43 (4), 316-320, 2005 | 37 | 2005 |
The leap-frog effect of ring currents in benzene A Ligabue, A Soncini, P Lazzeretti Journal of the American Chemical Society 124 (9), 2008-2014, 2002 | 37 | 2002 |
Magnetic response of dithiin molecules: is there anti-aromaticity in nature? S Pelloni, F Faglioni, A Soncini, A Ligabue, P Lazzeretti Chemical physics letters 375 (5-6), 583-590, 2003 | 29 | 2003 |
On the resolution of the optical rotatory power of chiral molecules into atomic terms. A study of hydrogen peroxide A Ligabue, P Lazzeretti, MPB Varela, MB Ferraro The Journal of chemical physics 116 (15), 6427-6434, 2002 | 26 | 2002 |
Didattica ludica: competenze in gioco A Ligabue Edizioni Centro Studi Erickson, 2023 | 21 | 2023 |
The ring-current model of the paratropic pentalene molecule IG Cuesta, A Ligabue, AS de Meras, P Lazzeretti Chemical physics letters 401 (1-3), 282-287, 2005 | 18 | 2005 |
Parity-violating effects in asymmetric chemical reactions: A theoretical study on the CHFClBr molecule A Soncini, A Ligabue, P Lazzeretti, R Zanasi Physical Review E 62 (6), 8395, 2000 | 18 | 2000 |
Theoretical determination of magnetic properties of planar benzene isomers A Ligabue, P Lazzeretti The Journal of chemical physics 116 (3), 964-973, 2002 | 17 | 2002 |