Reminder- Machine Learning for Electronic Structure

Submit by March 31, 2026 View in Browser SUBMIT AN ARTICLE MANAGE MY ALERTS ABOUT THE JOURNAL The Journal of Chemical Physics Call for Papers Special Topic: Machine Learning for Electronic Structure Machine learning has become a powerful tool to replace or accelerate electronic-structure calculations, for example by predicting interatomic potentials with high accuracy and low cost. Increasingly, ML is also integrated into modern quantum chemistry and electronic-structure theory, enhancing algorithms that describe the quantum behavior of electrons in molecules and materials. This Special Issue highlights three complementary themes:   Learning the ingredients of electronic-structure calculations: Contributions predicting electron densities, Hamiltonian elements, or other effective one- and two-body operators from atomic configurations, while exploiting symmetries and uncertainty quantification, are encouraged.   ML-accelerated many-body methods: Studies embedding ML models into wave-function theories—from coupled-cluster and multireference to variational and diffusion Monte Carlo—aiming to reduce scaling, extend reach, or improve accuracy.   Data-driven density functionals: Manuscripts developing and testing exchange–correlation functionals, kinetic-energy functionals, or orbital-free models with supervised, unsupervised, or reinforcement learning are welcome. Topics covered include, but are not limited to: • Machine learning (ML) • Electronic-structure calculations • Interatomic potentials • Quantum chemistry • Electronic-structure theory • Quantum mechanical behavior Guest Editors Michele Pavanello, Rutgers University Frank Noe, Microsoft Research AI for Science Julia Westermayr, University of Leipzig Submission Deadline: March 31, 2026 LEARN MORE > Tell Us What You Think! Did you like this email? Yes > No >  Follow us on social media   Copyright © 2025 AIP Publishing. All rights reserved. 1305 Walt Whitman Rd., Melville, NY 11747 You are receiving this email because you have opted-in to receive alerts from us. To guarantee delivery of this email please add journals@aip-info.org to your address book and safe senders list. If you no longer wish to receive emails from us then please unsubscribe or amend your settings. Privacy Policy

Biological Physics Topic Alert

Read the latest articles in Biological Physics View in Browser OUR JOURNALS MANAGE MY ALERTS ABOUT AIP PUBLISHING Biological Physics  December 2025 Topic Alert ALL ARTICLES > Experimental viscoelasticity of physiological protein solutions Alex Bulpitt,Karl Hawkins,Bharath Sundaramoorthy,Muthusankar Sudalaimuthu,Suresh Pillai,Francesco Del Giudice READ MORE > Attenuation of acoustic energy in transcranial magnetic stimulation coils by viscous media Daniel Veira-Canle,Maria A. Koponen,Ilkka Rissanen,Maxime Fauconnier,Dubravko Kicic,Tapio Lokki,Risto J. Ilmoniemi,Victor H. Souza,Heikki J. Nieminen READ MORE > Effects of duty cycle on passive acoustic monitoring metrics: The case of odontocete vocalizations Mathilde Michel,Julie Béesau,Maëlle Torterotot,Nicole Todd,Flore Samaran READ MORE > Preface: XVIII Mexican Symposium on Medical Physics 2024 READ MORE > Committees: XVIII Mexican Symposium on Medical Physics 2024 READ MORE > Sponsors: XVIII Mexican Symposium on Medical Physics 2024 READ MORE > The medical physics residencies recently created in Mexico: Results from the first four years María-Ester Brandan READ MORE > Quality assurance program in the manufacturing of low-cost mammography and radiography phantoms Juan S. Osnaya-Estrada,Héctor A. Galván-Espinoza,Jorge P. Castillo-López READ MORE > Estimation of the inherent filtration as function of the electrical voltage applied to an X-ray tube M. Angeles Montes Rodríguez,M. Raymundo Cabrera Vertti,Anahi Limas Escobar,José T. Álvarez Romero READ MORE > Assessment of image quality metrics in magnetic resonance imaging Viridiana Guzmán-Espinosa,Héctor A. Galván-Espinoza,Sandra L. Rocha-Nava,Jorge P. Castillo-López READ MORE > Detection of MCI in seniors during resting-state EEG with fractal dimension and AI classifiers Brenda Fernanda Noguez Ruiz,Erika Elizabeth Rodríguez Torres,Felipe Humberto Contreras Alcalá,Eleni Mitsoura,Alejandra Rosales Lagarde READ MORE > Evaluation of commercial and custom-made phantoms for quality control in contrast-enhanced mammography D. I. Ramírez,J. P. Castillo,H. A. Galván,M. E. Brandan READ MORE > Identification of tumoral region in CT images of cervical cancer using neural networks Georgina Waldo-Benítez,Luis Fernando Parra-Sánchez,Luis Carlos Padierna,Modesto Sosa READ MORE > Uncertainty analysis in dose determination with expired radiochromic films Zaira A. García-Nájera,Marisol Molina-Romero,Elsa Y. León-Marroquín,Jonathan Pérez-Honorato,M. A. Camacho-Lopez,Federico Miranda-Suárez,Gerardo Cerqueda-Milán READ MORE > Determination of X-ray tube voltage potential: Linearity of air kerma as a function of mAs and x-ray tube protection resistor M. Angeles Montes Rodríguez,Anahi Limas Escobar,M. Raymundo Cabrera Vertti,José T. Álvarez Romero READ MORE > Implementation and analysis of a vision-based optical densitometer for clinical dosimetry with radiochromic film Yanneth Tzitzin Chávez Gutiérrez,Miguel Ángel Camácho López,Gerardo Jiménez Aviles,Olivia Amanda García Garduño READ MORE > Status of clinical dosimeter calibration services and Dw conformity assessment for external photon and electron beams ININ-IAEA 2012-2022 Daniel de la Cruz Hernández,José Trinidad Álvarez Romero READ MORE > RR time series analysis during different stages of a stress test Ana María Aguilar-Molina,José Alberto Zamora-Justo,Rodrigo Isaac Rojas-Jiménez,Emilio Gabriel Miguel-Gómez,Paola Ximena Rojas-Montaño,Johana-Betzabé García-Bustamante,Alejandro Muñoz-Diosdado READ MORE > Variability of photoplethysmography morphological parameters from peripheral artery disease patients David Hernández Obín,Zurisadai Harim Torres Garay,Adriana Torres Machorro,Claudia Lerma González READ MORE > Breast glandular density in contrast mammography with dual-energy decomposition into 3 elements A. M. Hoyos-García,J. P. Castillo-López,G. Pacheco-Guevara,Y. Villaseñor-Navarro,M. E. Brandan READ MORE > Morphological and textural analysis in digital mammograms classifieds with artificial neural networks to support breast cancer detection: A pilot study F. E. Trujillo-Zamudio,M. V. Palma-Garzón,M. E. Hernández-Campos,E. Y. León-Marroquín READ MORE > In vivo study of cardiac muscle fibers using diffusion tensor imaging technique Jaime Torres Juárez,Sergio A. Patrón Chi,Silvia S. Hidalgo Tobón READ MORE > Remote quality control in digital mammography. Two experiences J. Sabino-Campechano,C. Ruiz-Trejo,R. Espejo-Fonseca,F. E. Trujillo-Zamudio READ MORE > Characterization of radiochromic films EBT-XD and MD-V3 with a clinical flatbed scanner Kenia María Ojeda-Soto,Miguel Ángel Camacho-López,Olivia Amanda García-Garduño,Gerardo Jiménez-Aviles READ MORE > Deep learning-based attenuation correction in brain PET studies Fernando Moncada,Arturo Avendaño-Estrada,Miguel Ángel Ávila-Rodríguez,Mercedes Rodríguez-Villafuerte,Arnulfo Martínez-Dávalos READ MORE > Complexity metrics in volumetric modulated arc therapy and the effect on quality control Natalia del Castillo-Escribano,Olga Olinca Galván-De La Cruz READ MORE > Generating a database for deep learning-based applications in multimodal tomography of the human brain Raúl Osorio-Durán,Gloria Angélica Adame-Ocampo,María de Lourdes Martínez-Gudiño,Mercedes Rodríguez-Villafuerte,Fernando Moncada-Gutiérrez,Arnulfo Martínez-Dávalos READ MORE > Evaluation of dose reduction methods in cone beam X-ray microtomography Gemma Aiddé Osorio-Durán,Mercedes Rodríguez-Villafuerte,Arnulfo Martínez-Dávalos READ MORE > Irradiation of a mixture of gold nanoparticles and rhodamine 6G with continuous Nd:YAG laser for application in photodynamic therapy and thermotherapy Geraldinne Vallejo,Eugenio Torres-García,Miguel Á. 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Carrera Martínez,Miguel Valle González READ MORE > Determination of dosimetric functions of a Ir-192 source and dose distribution verification for gynecological applicators in HDR Brachytherapy Joaquín Ignacio Escobar Arias,Eleni Mitsoura,Ariel Abigail Carrera Martínez,Miguel Valle González READ MORE > Stiffness-mediated paracrine signaling enhances induction of EMT in oral squamous cell carcinoma So Youn Moon,Marcelo Lazzaron Lamers,Adam J. Engler READ MORE > Prediction of chronic obstructive pulmonary disease based on multimodal data and deep learning Haoran Deng,Xuchun Ding,Shiping Zhu,Xue Song,Yufei Guo READ MORE > Structural characterization of anti-CRISPR protein AcrIE9 Jeehee Kang,Jasung Koo,Hyejin Oh,Euiyoung Bae READ MORE > Topological and geometrical signatures of computation in rate, spiking, and oscillatory neural reservoirs Oleg V. Maslennikov READ MORE > Metachronal coordination as a mesoscale phenomenon Sebastian Ziegler,Megan Delens,Ylona Collard,Maxime Hubert,Nicolas Vandewalle,Ana-Sunčana Smith READ MORE > Numerical simulation of hydrodynamics and propulsion in dense bioinspired fish schools under oblique flows Fulong Shi (石伏龙),石伏龙,Yu Tian (田宇),田宇,Jinlu Sheng (盛进路),盛进路,Ke Zhao (赵珂),赵珂,Jingxu Hao (郝京旭),郝京旭,Jinling Zhang (张晋玲),张晋玲 READ MORE > A feasibility study of an algorithm that identifies ascites on image-guided paracentesis Debora N. Nya,Mohamed Odeh,Jermaine J. Chambers,Scott R. Santeler,Olivia C. Coiado READ MORE > Bifurcation analysis of the driven FitzHugh–Nagumo oscillator: Prediction and experiment Edward H. 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Salih READ MORE > Follow us on social media   Copyright © 2026 AIP Publishing. All rights reserved. 1305 Walt Whitman Rd., Melville, NY 11747 You are receiving this email because you have opted-in to receive alerts from us. To guarantee delivery of this email please add alerts@aip-info.org to your address book and safe senders list. If you no longer wish to receive emails from us then please unsubscribe or amend your settings. Privacy Policy