Dissociation of high-pressure solid molecular hydrogen: A quantum Monte Carlo and anharmonic vibrational study S Azadi, B Monserrat, WMC Foulkes, RJ Needs Physical review letters 112 (16), 165501, 2014 | 144 | 2014 |
Resonating valence bond wave function with molecular orbitals: Application to first-row molecules M Marchi, S Azadi, M Casula, S Sorella The Journal of Chemical Physics 131 (15), 2009 | 103 | 2009 |
Fate of density functional theory in the study of high-pressure solid hydrogen S Azadi, WMC Foulkes Physical Review B 88 (1), 014115, 2013 | 85 | 2013 |
Quantum Monte Carlo study of high pressure solid molecular hydrogen S Azadi, WMC Foulkes, TD Kühne New Journal of Physics 15 (11), 113005, 2013 | 58 | 2013 |
When double-wall carbon nanotubes can become metallic or semiconducting R Moradian, S Azadi, H Refii-Tabar Journal of physics: condensed matter 19 (17), 176209, 2007 | 54 | 2007 |
Nature of the metallization transition in solid hydrogen S Azadi, ND Drummond, WMC Foulkes Physical Review B 95 (3), 035142, 2017 | 50 | 2017 |
Structure and electronic properties of native and defected gallium nitride nanotubes R Moradian, S Azadi, SV Farahani Physics Letters A 372 (46), 6935-6939, 2008 | 50 | 2008 |
Discovering quantum phase transitions with fermionic neural networks G Cassella, H Sutterud, S Azadi, ND Drummond, D Pfau, JS Spencer, ... Physical Review Letters 130 (3), 036401, 2023 | 48 | 2023 |
Quantum plasmonic nanoantennas JM Fitzgerald, S Azadi, V Giannini Physical Review B 95 (23), 235414, 2017 | 41 | 2017 |
Boron and nitrogen-doped single-walled carbon nanotube R Moradian, S Azadi Physica E: Low-dimensional Systems and Nanostructures 35 (1), 157-160, 2006 | 38 | 2006 |
Fate of the resonating valence bond in graphene M Marchi, S Azadi, S Sorella Physical Review Letters 107 (8), 086807, 2011 | 37 | 2011 |
Systematic study of finite-size effects in quantum Monte Carlo calculations of real metallic systems S Azadi, WMC Foulkes The Journal of chemical physics 143 (10), 2015 | 36 | 2015 |
The effect of Stone-Wales defect orientations on the electronic properties of single-walled carbon nanotubes S Azadi, R Moradian, AM Shafaee Computational materials science 49 (3), 699-703, 2010 | 36 | 2010 |
The role of van der Waals and exchange interactions in high-pressure solid hydrogen S Azadi, GJ Ackland Physical Chemistry Chemical Physics 19 (32), 21829-21839, 2017 | 29 | 2017 |
Magnetism in defected single-walled boron nitride nanotubes R Moradian, S Azadi Europhysics Letters 83 (1), 17007, 2008 | 29 | 2008 |
A consistent description of the iron dimer spectrum with a correlated single-determinant wave function M Casula, M Marchi, S Azadi, S Sorella Chemical Physics Letters 477 (4-6), 255-258, 2009 | 28 | 2009 |
Systematically convergent method for accurate total energy calculations with localized atomic orbitals S Azadi, C Cavazzoni, S Sorella Physical Review B 82 (12), 125112, 2010 | 27 | 2010 |
Chemical accuracy from quantum Monte Carlo for the benzene dimer S Azadi, RE Cohen The Journal of chemical physics 143 (10), 2015 | 26 | 2015 |
Absence of metallization in solid molecular hydrogen S Azadi, TD Kühne JETP letters 95, 449-453, 2012 | 25 | 2012 |
Nuclear quantum effects induce metallization of dense solid molecular hydrogen S Azadi, R Singh, TD Kühne Journal of computational chemistry 39 (5), 262-268, 2018 | 20 | 2018 |