A look at how the structure of amorphous graphene affects its electrical properties.
Nicolas Gastellu, Ata Madanchi, Lena Simine
― 5 min read
A look into the behavior of complex solutions in various fields.
Spencer P. Alliston, Chris Dames, Matthew J. Powell-Palm
― 6 min read
QM/MM combines quantum and molecular mechanics for better scientific insights.
Xin Chen, Jessica Martinez, Xuecheng Shao
― 6 min read
Nickelocene molecules interact with gold, revealing unique structures and potential applications.
Divya Jyoti, Alex Fétida, Laurent Limot
― 6 min read
Scientists use algorithms to study how atoms change states, like liquid to ice.
Lars Dammann, Richard Kohns, Patrick Huber
― 4 min read
ZnO monolayers show potential for efficient hydrogen storage solutions.
Aliezer Martinez-Mesa, Llinersy Uranga-Pinna, Nadine Halberstadt
― 4 min read
KerNN enhances the study of molecules by creating accurate potential energy surfaces efficiently.
Silvan Käser, Debasish Koner, Markus Meuwly
― 6 min read
Transforming the way scientists learn software through innovative online resources.
Gareth A. Tribello, Massimiliano Bonomi, Giovanni Bussi
― 6 min read
A look at neural network potentials transforming chemical prediction methods.
Felix Pultar, Moritz Thuerlemann, Igor Gordiy
― 6 min read
A new tool to simplify access to quantum data for scientists.
Cristian Gabellini, Nikhil Shenoy, Stephan Thaler
― 7 min read
Learn how diffusiophoresis affects tiny particles in liquids.
Siddharth Sambamoorthy, Henry C. W. Chu
― 5 min read
A new method simplifies molecule interaction studies, improving efficiency and accuracy.
Qi Yu, Ruitao Ma, Chen Qu
― 5 min read
Heptazine and water collaboration offers a sustainable path for hydrogen production.
Sebastian V. Pios, Maxim F. Gelin, Wolfgang Domcke
― 5 min read
Learn about basis set incompleteness errors and how scientists address these in quantum chemistry.
Kousuke Nakano, Benjamin X. Shi, Dario Alfè
― 5 min read
Discover how PAL transforms computer learning through active methods and automation.
Chen Zhou, Marlen Neubert, Yuri Koide
― 6 min read
Discover how protein size influences cell signaling and communication.
Arash Tirandaz, Abolfazl Ramezanpour, Vivi Rottschäfer
― 7 min read
New machine learning techniques enhance understanding of solvation behavior in mixtures.
Roel J. Leenhouts, Nathan Morgan, Emad Al Ibrahim
― 9 min read
Delving into how quasi-particles and self-energy shape molecular behavior.
Arno Förster
― 7 min read
New research sheds light on how chemical bonds form with the help of superfluid helium.
Michael Stadlhofer, Bernhard Thaler, Pascal Heim
― 5 min read
Quantum computing reshapes chemistry with new possibilities for solving complex problems.
Konrad Deka, Emil Zak
― 6 min read
Scientists develop a simpler technique for making platinum/iridium microscopy tips.
Yuto Nishiwaki, Toru Utsunomiya, Shu Kurokawa
― 6 min read
Understanding how electrons interact using the Pauli exclusion principle.
Julia Liebert, Federico Castillo, Jean-Philippe Labbé
― 6 min read
Scientists study hydrogen ions to reveal cosmic chemical processes.
Miguel Jiménez-Redondo, Olli Sipilä, Pavol Jusko
― 7 min read
Discover how fragmentation and machine learning transform molecular predictions and applications.
Xiao Zhu, Srinivasan S. Iyengar
― 14 min read
Discover how protons move and interact in water at the quantum level.
Debadrita Saha, Philip Richerme, Srinivasan S. Iyengar
― 7 min read
Explore how surfactants influence products from soaps to pharmaceuticals.
Chao Duan, Mu Wang, Ahmad Ghobadi
― 6 min read
Exploring how tiny molecules capture and transfer sunlight efficiently.
Joachim Galiana, Michèle Desouter-Lecomte, Benjamin Lasorne
― 5 min read
Discover how machine learning enhances the study of atomic interactions.
Philip Loche, Kevin K. Huguenin-Dumittan, Melika Honarmand
― 7 min read
Scientists uncover efficient pathways for molecule movement using advanced models.
Vladimir Grigorev
― 6 min read
A new method enhances molecular dynamics simulations for speed and accuracy.
Hongyu Yan, Qi Dai, Yong Wei
― 7 min read
Scientists refine atomic orbitals to improve predictions in quantum chemistry.
Trine Kay Quady, Sonja Bumann, Eric Neuscamman
― 6 min read
Discover how quantum computing is transforming vibrational calculations in science.
Michal Szczepanik, Emil Zak
― 6 min read
A new method combines machine learning and quantum dynamics to study electron behavior.
Nicholas J. Boyer, Christopher Shepard, Ruiyi Zhou
― 7 min read
Exploring methods for analyzing molecular interactions in chemistry.
YingXing Cheng, Benjamin Stamm
― 7 min read
Learn how the similarity-based method predicts liquid behavior with confidence.
Nicolas Hayer, Thomas Specht, Justus Arweiler
― 6 min read
A new approach in molecular dynamics offers better insights into molecular behavior when exposed to light.
Lea M. Ibele, Eduarda Sangiogo Gil, Peter Schürger
― 6 min read
Discover the fascinating world of nanostructures and their impact on technology.
Shohely Tasnim Anindo, Daniela Täuber, Christin David
― 6 min read
Explore the hidden complexities of fluid dynamics and contact lines.
Andreas Nold, Benjamin D. Goddard, David N. Sibley
― 7 min read
A fresh approach to simulate fermions using qudits enhances quantum research.
Rodolfo Carobene, Stefano Barison, Andrea Giachero
― 5 min read
New methods are changing how scientists study electron behavior in atoms.
Kristoffer Simula, Evelin Martine Corvid Christlmaier, Maria-Andreea Filip
― 6 min read