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Sara Kadkhodaei
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Year
Flaw insensitive fracture in nanocrystalline graphene
T Zhang, X Li, S Kadkhodaei, H Gao
Nano letters 12 (9), 4605-4610, 2012
2302012
The free energy of mechanically unstable phases
A Van De Walle, Q Hong, S Kadkhodaei, R Sun
Nature communications 6 (1), 1-6, 2015
562015
Software tools for high-throughput CALPHAD from first-principles data
A van de Walle, R Sun, QJ Hong, S Kadkhodaei
Calphad 58, 70-81, 2017
532017
Free energy calculation of mechanically unstable but dynamically stabilized bcc titanium
S Kadkhodaei, QJ Hong, A Van De Walle
Physical Review B 95 (6), 064101, 2017
392017
First-principles calculations of thermal properties of the mechanically unstable phases of the PtTi and NiTi shape memory alloys
S Kadkhodaei, A van de Walle
Acta Materialia 147, 296-303, 2018
232018
Phonon-assisted diffusion in bcc phase of titanium and zirconium from first principles
S Kadkhodaei, A Davariashtiyani
Physical Review Materials 4 (4), 043802, 2020
132020
Epicycle method for elasticity limit calculations
A Van De Walle, S Kadkhodaei, R Sun, QJ Hong
Physical Review B 95 (14), 144113, 2017
102017
A simple local expression for the prefactor in transition state theory
S Kadkhodaei, A van de Walle
The Journal of Chemical Physics 150 (14), 144105, 2019
82019
Predicting synthesizability of crystalline materials via deep learning
A Davariashtiyani, Z Kadkhodaie, S Kadkhodaei
Communications Materials 2 (1), 1-11, 2021
62021
Software tools for thermodynamic calculation of mechanically unstable phases from first-principles data
S Kadkhodaei, A van de Walle
Computer Physics Communications 246, 106712, 2020
62020
Cluster Expansion of Alloy Theory: A Review of Historical Development and Modern Innovations
S Kadkhodaei, JA Muñoz
JOM 73 (11), 3326-3346, 2021
52021
Computational design of corrosion-resistant and wear-resistant titanium alloys for orthopedic implants
N Siony, L Vuong, O Lundaajamts, S Kadkhodaei
Materials Today Communications 33, 104465, 2022
2022
Zirconium Machine Learned Potential Trained on a Euclidean Neural Network
V Meraz, S Gomez, V Arteaga Muniz, A De la Rocha Galán, T Smidt, ...
Bulletin of the American Physical Society, 2022
2022
Understanding the role of anharmonic phonons in diffusion of bcc metals
S Fattahpour, A Davariashtiyani, S Kadkhodaei
Physical Review Materials 6 (2), 023803, 2022
2022
Phonon-assisted diffusion in bcc phase of titanium from first-principles
S Kadkhodaei, A Davariashtiyani
arXiv, arXiv: 1910.05806, 2019
2019
Computational Design of Corrosion-Resistant and Wear-Resistant Titanium Alloys for Permanent Joint Implants
N Siony, L Vuong, O Lundaajamts, S Kadkhodaei
Available at SSRN 4180111, 0
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Articles 1–16