Quantum Chemistry Topic Alert

Read the latest articles in Quantum Chemistry View in Browser OUR JOURNALS MANAGE MY ALERTS ABOUT AIP PUBLISHING Quantum Chemistry  April 2026 Topic Alert Plasma-assisted atomic layer etching of single-crystal diamond J. S. Draney,A. Z. Panagiotopoulos,D. B. Graves READ MORE > An optimal lower bound for the low density Fermi gas Emanuela L. Giacomelli READ MORE > DFT insights into the adsorption performance of the anti-cancer drug nitrosourea on graphene/boron nitride heterostructures Riya Rani Kundu,Mehedi Hasan Opi,Afiya Akter Piya,Prince Saha,Siraj Ud Daula Shamim READ MORE > Ion correlation effect on electron screening of moderately coupled plasma Fuyang Zhou,Guangwei Meng,Yizhi Qu,Yong Wu,Jianguo Wang READ MORE > framework for symbolic and numerical tensor algebra. I. Core capabilities Bimal Gaudel,Robert G. Adam,Ajay Melekamburath,Conner Masteran,Nakul Teke,Azam Besharatnik,Andreas Köhn,Edward F. Valeev READ MORE > Nuclear–electronic orbital quasiclassical trajectory method for vibrational spectroscopy Chiara Aieta,Scott M. Garner,Aodong Liu,Xiaosong Li,Sharon Hammes-Schiffer READ MORE > Impact of density and disorder on the low-temperature heat capacity of carbon–carbon composites A. I. Krivchikov,A. Jeżowski,M. S. Barabashko,G. Dovbeshko,D. E. Hurova,N. N. Galtsov,V. Boiko,Yu. Sementsov,A. Glamazda,V. Sagan,Yu. Horbatenko,O. A. Korolyuk,O. O. Romantsova,D. Szewczyk READ MORE > Photonic and electronic properties of two-dimensional GaN monolayer and AA/AA′ stacked structures: First-principles and quantum transport simulations Benren Xie,Zhengdao Li,Yu Wang,Meng Qi,Jianbao Wu READ MORE > Characterization of dynamics of encapsulated small molecule Nile red in biodegradable polymer using 2D IR methods Anneka Miller Casas,Victor Wen,Nehal S. Idris,Joseph P. Patterson,Nien-Hui Ge READ MORE > Amide isomerization pathways II: Tracing geometrical prerequisites of acid-catalyzed amide cis – trans isomerization in globular proteins Ádám A. Kelemen,Zsolt Fazekas,Dóra K. Menyhárd,András Perczel,Imre Jákli READ MORE > Higher-order Weyl semimetals on nonorientable manifolds Yuzeng Li,Juan Du,Chunyin Qiu READ MORE > Open-shell frozen natural orbital approach for quantum eigensolvers Angela F. Harper,Xiaobing Liu,Scott N. Genin,Ilya G. Ryabinkin READ MORE > M1 transitions induced by twisted photons with an effective perturbation A. Samsonenko,O. Minakova,S. Veber,V. Serbo READ MORE > Efficient Boys function evaluation using minimax approximation Rasmus Vikhamar-Sandberg,Michal Repisky READ MORE > Theoretical study on structures, stability, and bonding of Ng-inserted nitrogen-group fluorides FNgMFn (Ng = Kr, Xe; M = P, As, Sb; n = 2, 4) Zhihua Luo,Zhifan Wang,Fan Wang READ MORE > Exploring composition fluctuations and their dynamics in binary mixtures using coarse-grained molecular dynamics Siddharth Sundararaman,Suman Chakraborty,G. Brian Stephenson,Michael J. Servis,Subramanian K. R. S. Sankaranarayanan READ MORE > Microscopic mechanisms of hydrogen depassivation at amorphous SiO2/Si interfaces Lin-Jie Yang,Zhi-Qi Liu,Jie-Xi Wang,Yue Huang,Bin Shao,Pei Li 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