Publications by authors named "Amit Samanta"

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Direct Observation of the Exciton-Polaron in Single CsPbBr Quantum Dots.
Zhou Shen, Margarita Samoli, Onur Erdem, Johan Bielecki, Amit K Samanta

ACS Nano· August 2025

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Advancing time-resolved structural biology: latest strategies in cryo-EM and X-ray crystallography.
Amir Banari, Amit K Samanta, Anna Munke, Tim Laugks, Saša Bajt

Nat Methods· July 2025

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Atomic-Scale Dynamics of Five-Fold Twin Mediated Coalescence: Pathway-Dependent and Defect-Governed Nonclassical Growth Mechanisms.
Hongshan Wang, Miriding Mutailipu, Loukya Boddapati, Amit Samanta, Francis Leonard Deepak

J Am Chem Soc· June 2025

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Deep learning: A game changer in drug design and development.
Sushanta Kumar Das, Rahul Mishra, Amit Samanta, Dibyendu Shil, Saumendu Deb Roy

Adv Pharmacol· April 2025

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Laser-Induced Alignment of Nanoparticles and Macromolecules for Coherent-Diffractive-Imaging Applications.
Muhamed Amin, Jean-Michel Hartmann, Amit K Samanta, Jochen Küpper

J Am Chem Soc· March 2025

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Direct experimental constraints on the spatial extent of a neutrino wavepacket.
Joseph Smolsky, Kyle G Leach, Ryan Abells, Pedro Amaro, Adrien Andoche, Amit Samanta

Nature· February 2025

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Accuracy and Performance Evaluation of Low Density Internal and External Flow Predictions using CFD and DSMC.
Surya Kiran Peravali, Vahid Jafari, Amit K Samanta, Jochen Küpper, Muhamed Amin

Comput Fluids· July 2024

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Unraveling the Correlation between the Interface Structures and Tunable Magnetic Properties of LaSrCoO/LaSrMnO Bilayers Using Deep Learning Models.
Hong Sun, Vincenzo Lordi, Yayoi Takamura, Amit Samanta

ACS Appl Mater Interfaces· June 2024

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Resolving Nonequilibrium Shape Variations among Millions of Gold Nanoparticles.
Zhou Shen, Paul Lourdu Xavier, Richard Bean, Johan Bielecki, Martin Bergemann, Amit K Samanta

ACS Nano· June 2024

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Observation of a single protein by ultrafast X-ray diffraction.
Tomas Ekeberg, Dameli Assalauova, Johan Bielecki, Rebecca Boll, Benedikt J Daurer, Amit K Samanta

Light Sci Appl· January 2024

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Graph-EAM: An Interpretable and Efficient Graph Neural Network Potential Framework.
Jun Yang, Zhitao Chen, Hong Sun, Amit Samanta

J Chem Theory Comput· September 2023

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Time-Resolved Single-Particle X-ray Scattering Reveals Electron-Density Gradients As Coherent Plasmonic-Nanoparticle-Oscillation Source.
Dominik Hoeing, Robert Salzwedel, Lena Worbs, Yulong Zhuang, Amit K Samanta

Nano Lett· July 2023

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Unsupervised learning approaches to characterizing heterogeneous samples using X-ray single-particle imaging.
Yulong Zhuang, Salah Awel, Anton Barty, Richard Bean, Johan Bielecki, Amit K Samanta

IUCrJ· March 2022

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Accurate parameterization of the kinetic energy functional for calculations using exact-exchange.
Shashikant Kumar, Babak Sadigh, Siya Zhu, Phanish Suryanarayana, Sebastian Hamel, Amit Samanta

J Chem Phys· January 2022

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Accurate parameterization of the kinetic energy functional.
Shashikant Kumar, Edgar Landinez Borda, Babak Sadigh, Siya Zhu, Sebastian Hamel, Amit Samanta

J Chem Phys· January 2022

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Optimizing the geometry of aerodynamic lens injectors for single-particle coherent diffractive imaging of gold nanoparticles.
Lena Worbs, Nils Roth, Jannik Lübke, Armando D Estillore, P Lourdu Xavier, Amit K Samanta

J Appl Crystallogr· December 2021

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Quantized Grain Boundary States Promote Nanoparticle Alignment During Imperfect Oriented Attachment.
Andrew P Lange, Amit Samanta, Tammy Y Olson, Selim Elhadj

Small· July 2020

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Controlled beams of shock-frozen, isolated, biological and artificial nanoparticles.
Amit K Samanta, Muhamed Amin, Armando D Estillore, Nils Roth, Lena Worbs

Struct Dyn· March 2020

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Light-sheet imaging for the recording of transverse absolute density distributions of gas-phase particle-beams from nanoparticle injectors.
Lena Worbs, Jannik Lübke, Nils Roth, Amit K Samanta, Daniel A Horke

Opt Express· December 2019

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Representing local atomic environment using descriptors based on local correlations.
Amit Samanta

J Chem Phys· December 2018

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Rapid sample delivery for megahertz serial crystallography at X-ray FELs.
Max O Wiedorn, Salah Awel, Andrew J Morgan, Kartik Ayyer, Yaroslav Gevorkov, Amit K Samanta

IUCrJ· September 2018

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The thermodynamics of a liquid-solid interface at extreme conditions: A model close-packed system up to 100 GPa.
Amit Samanta, Jonathan L Belof

J Chem Phys· September 2018

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Predicting phase behavior of grain boundaries with evolutionary search and machine learning.
Qiang Zhu, Amit Samanta, Bingxi Li, Robert E Rudd, Timofey Frolov

Nat Commun· February 2018

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Descriptor-Based Approach for the Prediction of Cation Vacancy Formation Energies and Transition Levels.
Joel B Varley, Amit Samanta, Vincenzo Lordi

J Phys Chem Lett· October 2017

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Antagonistic Interplay Between an Intermolecular CH···O and an Intramolecular OH···O Hydrogen Bond in a 1:1 Complex Between 1,2-Cyclohexanedione and Chloroform: A Combined Matrix Isolation Infrared and Quantum Chemistry Study.
Amit Kumar Samanta, Pujarini Banerjee, Biman Bandyopadhyay, Prasenjit Pandey, Tapas Chakraborty

J Phys Chem A· August 2017

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