Exploring the interactions of iridium and zirconium carbide at high temperatures.
Ya. A. Nikiforov, V. A. Danilovsky, N. I. Baklanova
― 4 min read
A look at how Gaussian wave packets behave in quantum dynamics.
Simon Elias Schrader, Thomas Bondo Pedersen, Simen Kvaal
― 6 min read
Water exhibits strange behaviors that puzzle scientists and challenge our expectations.
Yuvraj Singh, Mantu Santra, Rakesh S. Singh
― 5 min read
Scientists develop a method to study water behavior in confined areas.
Dil K. Limbu, Nathan London, Md Omar Faruque
― 4 min read
A look into the methods that transform our understanding of quantum interactions.
Bing Gu
― 9 min read
A new method improves calculations for molecular interactions, enhancing efficiency and accuracy.
Yu Hsuan Liang, Xing Zhang, Garnet Kin-Lic Chan
― 6 min read
Scientists merge DMRG and Coupled-Cluster methods to enhance understanding of molecular behavior.
Nicholas Bauman, Libor Veis, Karol Kowalski
― 6 min read
Study reveals intriguing dynamics of neon dimers when exposed to laser energy.
D. Blume, Q. Guan, J. Kruse
― 6 min read
MDRefine enhances accuracy of molecular dynamics simulations for scientific research.
Ivan Gilardoni, Valerio Piomponi, Thorben Fröhlking
― 5 min read
Discover how materials respond to magnetic fields and their technological impact.
Sophia Burger, Stella Stopkowicz, Jürgen Gauss
― 6 min read
Exploring the impact of geometric phase effects on electronic structure methods.
Eirik F. Kjønstad, Henrik Koch
― 6 min read
Conical intersections are key in understanding molecular behaviors under light exposure.
Sara Angelico, Eirik F. Kjønstad, Henrik Koch
― 6 min read
Explore the fascinating Leidenfrost effect and how droplets behave on hot surfaces.
René Ledesma-Alonso, Benjamin Lalanne, Jesús Israel Morán-Cortés
― 6 min read
New methods enhance chemical simulations using quantum technology.
J. Wayne Mullinax, Panagiotis G. Anastasiou, Jeffrey Larson
― 8 min read
Using neural networks to streamline the preparation of quantum many-body states.
Weillei Zeng, Jiaji Zhang, Lipeng Chen
― 6 min read
Scientists investigate how molecules react in optical cavities influenced by ambient noise.
Yaling Ke
― 5 min read
A study on improving energy models for halogenated compounds.
Kham Lek Chaton, Markus Meuwly
― 6 min read
A look into how molecules interact and the importance of energy levels.
Federico Rossi, Eirik F. Kjønstad, Sara Angelico
― 6 min read
Advancements in machine learning enhance understanding of superionic conductors.
Junlan Liu, Qian Yin, Mengshu He
― 6 min read
MixPI enhances simulations of tiny particles, bringing clarity to quantum interactions.
Britta A. Johnson, Siyu Bu, Christopher J. Mundy
― 8 min read
A new project aims to improve catalyst discovery for clean energy production.
Jehad Abed, Jiheon Kim, Muhammed Shuaibi
― 5 min read
Discover how scientists study the complex interactions of water's hydrogen atoms.
Dietmar Paschek, Johanna Busch, Angel Mary Chiramel Tony
― 6 min read
Scientists investigate how atoms form molecules at ultracold temperatures.
Robert C. Bird, Jeremy M. Hutson
― 7 min read
New basis set vDZP offers quick and accurate results in quantum chemistry calculations.
Corin C. Wagen, Jonathon E. Vandezande
― 6 min read
A look into how conjugated polymers interact with light and each other.
Henry J. Kantrow, Elizabeth Gutiérrez-Meza, Hongmo Li
― 6 min read
Learn how heat affects lithium-ion batteries and their performance.
Felix Schloms, Øystein Gullbrekken, Signe Kjelstrup
― 5 min read
BaZrS3 shows potential for sustainable energy without lead.
Prakriti Kayastha, Erik Fransson, Paul Erhart
― 5 min read
Exploring how singlet fission may enhance solar energy efficiency.
Alexandru G. Ichert, William Barford
― 7 min read
Learn about benzophenone and its role in protecting skin from UV damage.
Lorenzo Restaino, Thomas Schnappinger, Markus Kowalewski
― 5 min read
A look into how molecules interact and the methods used to study them.
S. Lambie, D. Kats, D. Usyvat
― 5 min read
A look into how light and matter interact and impact our world.
Ilia Mazin, Yu Zhang
― 6 min read
Discover the intricate structures within water that support life.
Fujie Tang, Diana Y. Qiu, Xifan Wu
― 5 min read
ChemSafetyBench tests chatbots on chemical safety and knowledge.
Haochen Zhao, Xiangru Tang, Ziran Yang
― 6 min read
A look at how technology helps chemists find efficient reaction routes.
Adittya Pal, Rolf Fagerberg, Jakob Lykke Andersen
― 5 min read
MOLPIPx aids scientists in accurately modeling molecular movements using advanced techniques.
Manuel S. Drehwald, Asma Jamali, Rodrigo A. Vargas-Hernández
― 5 min read
This article examines unusual speed behaviors of particles in quantum tunneling reactions.
Christian Beck, Constantino Tsallis
― 5 min read
A new method enhances modeling of material phase changes.
Wolfgang Flachberger, Thomas Antretter, Daniel Acosta-Soba
― 6 min read
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