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Items where Author is "Ghasemi, S. Alireza"

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Number of items: 19.

2021

Rostami, Samare and Ghasemi, S. Alireza and Goedecker, Stefan. (2021) Novel polymorphs and polytypes of lithium chloride from structure predictions based on charge equilibration via neural network technique. Physical Review Materials, 5 (12). p. 123603.

2019

Faraji, Somayeh and Ghasemi, S. Alireza and Parsaeifard, Behnam and Goedecker, Stefan. (2019) Surface reconstructions and premelting of the (100) CaF2 surface. Physical Chemistry Chemical Physics, 21 (29). pp. 16270-16281.

2017

Eivari, Hossein Asnaashari and Ghasemi, S. Alireza and Tahmasbi, Hossein and Rostami, Samare and Faraji, Somayeh and Rasoulkhani, Robabe and Goedecker, Stefan and Amsler, Maximilian. (2017) Two-Dimensional Hexagonal Sheet of TiO2. Chemistry of Materials, 29 (20). pp. 8594-8603.

2016

Zhu, Li and Amsler, Maximilian and Fuhrer, Tobias and Schaefer, Bastian and Faraji, Somayeh and Rostami, Samare and Ghasemi, S. Alireza and Sadeghi, Ali and Grauzinyte, Migle and Wolverton, Chris and Goedecker, Stefan. (2016) A fingerprint based metric for measuring similarities of crystalline structures. Journal of Chemical Physics, 144 (3). 034203.

2015

Ghasemi, S. Alireza and Hofstetter, Albert and Saha, Santanu and Goedecker, Stefan. (2015) Interatomic potentials for ionic systems with density functional accuracy based on charge densities obtained by a neural network. Physical review B: Condensed matter and materials physics, 92 (4). 045131.

Schaefer, Bastian and Ghasemi, S. Alireza and Roy, Shantanu and Goedecker, Stefan. (2015) Stabilized quasi-Newton optimization of noisy potential energy surfaces. Journal of Chemical Physics, 142 (3). 034112.

2014

Ghasemi, S. Alireza and Lenosky, Thomas J. and Amsler, Maximilian and Sadeghi, Ali and Genovese, Luigi and Goedecker, Stefan. (2014) Energetic and vibrational analysis of hydrogenated silicon m vacancies above saturation. Physical review B: Condensed matter and materials physics, 90 (5). 054117.

2013

Sadeghi, Ali and Ghasemi, S. Alireza and Schaefer, Bastian and Mohr, Stephan and Lill, Markus A. and Goedecker, Stefan. (2013) Metrics for measuring distances in configuration spaces. Journal of Chemical Physics, 139 (18). p. 184118.

2012

Amsler, Maximilian and Flores-Livas, Jose A. and Lehtovaara, Lauri and Balima, Felix and Ghasemi, S. Alireza and Machon, Denis and Pailhes, Stephane and Willand, Alexander and Caliste, Damien and Botti, Silvana and San Miguel, Alfonso and Goedecker, Stefan and Marques, Miguel A. L.. (2012) Crystal Structure of Cold Compressed Graphite. Physical Review Letters, 108 (6). 065501.

Sadeghi, Ali and Baratoff, Alexis and Ghasemi, S. Alireza and Goedecker, Stefan and Glatzel, Thilo and Kawai, Shigeki and Meyer, Ernst. (2012) Multiscale approach for simulations of Kelvin probe force microscopy with atomic resolution. Physical Review B, Vol. 86, H. 7 , 075407.

2011

Ghasemi, S. Alireza and Goedecker, Stefan. (2011) An enhanced splined saddle method. Journal of Chemical Physics, 135 (1). 014108.

Pochet, Pascal and Genovese, Luigi and De, Sandip and Goedecker, Stefan and Caliste, Damien and Ghasemi, S. Alireza and Bao, Kuo and Deutsch, Thierry. (2011) Low-energy boron fullerenes: Role of disorder and potential synthesis pathways. PHYSICAL REVIEW B, 83 (8). 081403.

De, Sandip and Ghasemi, S. Alireza and Willand, Alexander and Genovese, Luigi and Kanhere, Dilip and Goedecker, Stefan. (2011) The effect of ionization on the global minima of small and medium sized silicon and magnesium clusters. Journal of Chemical Physics, 134 (12). p. 124302.

2010

Ghasemi, S. Alireza and Amsler, Maximilian and Hennig, Richard G. and Roy, Shantanu and Goedecker, Stefan and Lenosky, Thomas J. and Umrigar, C. J. and Genovese, Luigi and Morishita, Tetsuya and Nishio, Kengo. (2010) Energy landscape of silicon systems and its description by force fields, tight binding schemes, density functional methods, and quantum Monte Carlo methods. Physical Review B, Vol. 81, H. 21 , 214107.

Willand, Alex and Gramzow, Matthias and Ghasemi, S. Alireza and Genovese, Luigi and Deutsch, Thierry and Reuter, Karsten and Goedecker, Stefan. (2010) Structural metastability of endohedral silicon fullerenes. Physical Review B, Vol. 81, H. 20 , 201405.

2009

Amsler, Maximilian and Ghasemi, S. Alireza and Goedecker, Stefan and Neelov, Alexey and Genovese, Luigi. (2009) Adsorption of small NaCl clusters on surfaces of silicon nanostructures. Nanotechnology, Vol. 20, H. 44 , 445301, 6 S..

2008

Ghasemi, S. Alireza and Goedecker, Stefan and Baratoff, Alexis and Lenosky, Thomas and Meyer, Ernst and Hug, Hans J.. (2008) Ubiquitous mechanisms of energy dissipation in noncontact atomic force microscopy. Physical review letters, Vol. 100, H. 23 , 236106, 4 S..

2007

Ghasemi, S. Alireza and Neelov, Alexey and Goedecker, Stefan. (2007) A particle-particle, particle-density algorithm for the calculation of electrostatic interactions of particles with slablike geometry. Journal of Chemical Physics, 127 (22). p. 224102.

Neelov, Alexey and Ghasemi, S. Alireza and Goedecker, Stefan. (2007) Particle-particle, particle-scaling function algorithm for electrostatic problems in free boundary conditions. Journal of Chemical Physics, 127 (2). 024109.

This list was generated on Thu Apr 18 03:40:50 2024 CEST.