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Journal Articles

Tailoring Li assisted CZTSe film growth under controllable selenium partial pressure and solar cells

Yue Liu, Huamei Zhang, Rutao Meng, Jiabin Dong, Xuejun Xu, Jincheng Zhang, Yi Zhang
Journal: The Journal of Chemical Physics
J. Chem. Phys. 161, 124709 (2024)
https://doi.org/10.1063/5.0232512
Published: September 2024
View article titled, Tailoring Li assisted CZTSe film growth under controllable selenium partial pressure and solar cells
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Journal Articles

A microscopic approach to crystallization: Challenging the classical/non-classical dichotomy

James F. Lutsko, Cédric Schoonen
Journal: The Journal of Chemical Physics
J. Chem. Phys. 161, 104502 (2024)
https://doi.org/10.1063/5.0225658
Published: September 2024
View article titled, A microscopic approach to crystallization: Challenging the classical/non-classical dichotomy
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Journal Articles

Bridging classical nucleation theory and molecular dynamics simulation for homogeneous ice nucleation

Min Lin, Zhewen Xiong, Haishan Cao
Journal: The Journal of Chemical Physics
J. Chem. Phys. 161, 084504 (2024)
https://doi.org/10.1063/5.0216645
Published: August 2024
View article titled, Bridging classical nucleation theory and molecular dynamics simulation for homogeneous ice nucleation
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Journal Articles

A quantitative theory and atomistic simulation study on the soft-sphere crystal–melt interfacial properties. I. Kinetic coefficients

Ya-Shen Wang, Xin Zhang, Zun Liang, Hong-Tao Liang, Yang Yang, Brian B. Laird
Journal: The Journal of Chemical Physics
J. Chem. Phys. 161, 084708 (2024)
https://doi.org/10.1063/5.0216556
Published: August 2024
View article titled, A quantitative theory and atomistic simulation study on the soft-sphere crystal–melt interfacial properties. I. Kinetic coefficients
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Journal Articles

Harvesting nucleating structures in nanoparticle crystallization: The example of gold, silver, and iron

Arthur France-Lanord, Sarath Menon, Julien Lam
Journal: The Journal of Chemical Physics
J. Chem. Phys. 161, 044108 (2024)
https://doi.org/10.1063/5.0200850
Published: July 2024
View article titled, Harvesting nucleating structures in nanoparticle crystallization: The example of gold, silver, and iron
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Journal Articles

Crystallization and the liquid–liquid critical point in nonbonded modified-WAC models

Erik Lascaris, Francesca Marchese, Nicole Gaspar
Journal: The Journal of Chemical Physics
J. Chem. Phys. 161, 044503 (2024)
https://doi.org/10.1063/5.0215601
Published: July 2024
View article titled, Crystallization and the liquid–liquid critical point in nonbonded modified-WAC models
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Journal Articles

Random close packing of semi-flexible polymers in two dimensions: Emergence of local and global order

Daniel Martínez-Fernández, Clara Pedrosa, Miguel Herranz, Katerina Foteinopoulou, Nikos Ch. Karayiannis, Manuel Laso
Journal: The Journal of Chemical Physics
J. Chem. Phys. 161, 034902 (2024)
https://doi.org/10.1063/5.0216436
Published: July 2024
View article titled, Random close packing of semi-flexible polymers in two dimensions: Emergence of local and global order
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Journal Articles

The interface between ice and alcohols analyzed by atomic force microscopy

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Ryo Yanagisawa, Tadashi Ueda, Kei-ichi Nakamoto, Zhengxi Lu, Hiroshi Onishi, Taketoshi Minato
Journal: The Journal of Chemical Physics
J. Chem. Phys. 161, 024702 (2024)
https://doi.org/10.1063/5.0211501
Published: July 2024
View article titled, The interface between ice and alcohols analyzed by atomic force microscopy
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Journal Articles

Exploring surface properties and premelting in crystals

Azat O. Tipeev, Alexander L. Gurashkin, Edgar D. Zanotto
Journal: The Journal of Chemical Physics
J. Chem. Phys. 160, 224705 (2024)
https://doi.org/10.1063/5.0210127
Published: June 2024
View article titled, Exploring surface properties and premelting in crystals
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Journal Articles

Flash melting amorphous ice

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Nathan J. Mowry, Constantin R. Krüger, Gabriele Bongiovanni, Marcel Drabbels, Ulrich J. Lorenz
Journal: The Journal of Chemical Physics
J. Chem. Phys. 160, 184502 (2024)
https://doi.org/10.1063/5.0202948
Published: May 2024
View article titled, Flash melting amorphous ice
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Includes: Supplementary data
Journal Articles

Effects of carbon concentration on the local atomic structure of amorphous GST

Robert J. Appleton, Zachary D. McClure, David P. Adams, Alejandro Strachan
Journal: The Journal of Chemical Physics
J. Chem. Phys. 160, 174702 (2024)
https://doi.org/10.1063/5.0203532
Published: May 2024
View article titled, Effects of carbon concentration on the local atomic structure of amorphous GST
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Includes: Supplementary data
Journal Articles

Classification of complex local environments in systems of particle shapes through shape symmetry-encoded data augmentation

Shih-Kuang (Alex) Lee, Sun-Ting Tsai, Sharon C. Glotzer
Journal: The Journal of Chemical Physics
J. Chem. Phys. 160, 154102 (2024)
https://doi.org/10.1063/5.0194820
Published: April 2024
View article titled, Classification of complex local environments in systems of particle shapes through shape symmetry-encoded data augmentation
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Includes: Supplementary data
Journal Articles

Atomic insights into shock-induced alloying reaction of premixed Ni/Al nanolaminates

Yifan Xie, Jian-Li Shao, Rui Liu, Pengwan Chen
Journal: The Journal of Chemical Physics
J. Chem. Phys. 159, 174702 (2023)
https://doi.org/10.1063/5.0171468
Published: November 2023
View article titled, Atomic insights into shock-induced alloying reaction of premixed Ni/Al nanolaminates
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Journal Articles

Optothermal crystallization of hard spheres in an effective bidimensional geometry

Vincenzo Ruzzi, Jacopo Baglioni, Roberto Piazza
Journal: The Journal of Chemical Physics
J. Chem. Phys. 159, 154904 (2023)
https://doi.org/10.1063/5.0169221
Published: October 2023
View article titled, Optothermal crystallization of hard spheres in an effective bidimensional geometry
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Includes: Supplementary data
Journal Articles

Molecular simulation of the confined crystallization of ice in cement nanopore

Xinping Zhu, Matthieu Vandamme, Zhengwu Jiang, Laurent Brochard
Journal: The Journal of Chemical Physics
J. Chem. Phys. 159, 154704 (2023)
https://doi.org/10.1063/5.0169783
Published: October 2023
View article titled, Molecular simulation of the confined crystallization of ice in cement nanopore
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Includes: Supplementary data
Journal Articles

Crystallization of FAPbI3: Polytypes and stacking faults

Paramvir Ahlawat
Journal: The Journal of Chemical Physics
J. Chem. Phys. 159, 151102 (2023)
https://doi.org/10.1063/5.0165285
Published: October 2023
View article titled, Crystallization of FAPbI<sub>3</sub>: Polytypes and stacking faults
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Includes: Supplementary data
Journal Articles

Evidence for liquid-liquid phase separation during the early stages of Mg-struvite formation

Stephanos Karafiludis, Ernesto Scoppola, Stephan E. Wolf, Zdravko Kochovski, David Matzdorff, Alexander E. S. Van Driessche, Jörn Hövelmann, Franziska Emmerling, Tomasz M. Stawski
Journal: The Journal of Chemical Physics
J. Chem. Phys. 159, 134503 (2023)
https://doi.org/10.1063/5.0166278
Published: October 2023
View article titled, Evidence for liquid-liquid phase separation during the early stages of Mg-struvite formation
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Includes: Supplementary data
Journal Articles

In search of a precursor for crystal nucleation of hard and charged colloids

Marjolein de Jager, Frank Smallenburg, Laura Filion
Journal: The Journal of Chemical Physics
J. Chem. Phys. 159, 134902 (2023)
https://doi.org/10.1063/5.0161356
Published: October 2023
View article titled, In search of a precursor for crystal nucleation of hard and charged colloids
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Includes: Supplementary data
Journal Articles

Tuning the crystallization and thermal properties of polyesters by introducing functional groups that induce intermolecular interactions

Leire Sangroniz, Yoon-Jung Jang, Marc A. Hillmyer, Alejandro J. Müller
Journal: The Journal of Chemical Physics
J. Chem. Phys. 159, 084901 (2023)
https://doi.org/10.1063/5.0165951
Published: August 2023
View article titled, Tuning the crystallization and thermal properties of polyesters by introducing functional groups that induce intermolecular interactions
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Includes: Supplementary data
Journal Articles

Understanding the role of polymers on the nucleating behavior of water in dilute supercooled solutions

Aindrila Indra, Mangesh Bhendale, Jayant K. Singh
Journal: The Journal of Chemical Physics
J. Chem. Phys. 159, 044502 (2023)
https://doi.org/10.1063/5.0153670
Published: July 2023
View article titled, Understanding the role of polymers on the nucleating behavior of water in dilute supercooled solutions
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Includes: Supplementary data