Orbital angular momentum textures and currents in a discrete helix: Equilibrium and linear response [0.03%]
离散螺旋中的轨道角动量纹和电流：平衡态与线性响应
Danny Cordova,Bertrand Berche,Ernesto Medina
Danny Cordova
Recently, nonequilibrium orbital angular momentum in low-dimensional systems has attracted renewed attention. Here, we introduce a minimal three-orbital tight-binding model for a single helical chain and show that chirality alone generates ...
Modulating intermolecular interactions and vibrational energy transfer in energetic systems with external electric fields [0.03%]
外部电场在能源系统中调节分子间相互作用及振动能量转移的影响
Zhaohua Cui,Rui Liu,Zhen Gong et al.
Zhaohua Cui et al.
The controllable application and property modulation of energetic materials is a long-standing challenge, as their macroscopic behavior fundamentally depends on structures formed by microscopic intermolecular interactions and the accompanyi...
Publisher's Note: "Reentrant phase transition in pH-responsive microgel suspensions" [J. Chem. Phys. 165, 024903 (2026)] [0.03%]
出版者附言：“pH响应性微凝胶悬浮液中的回滞相变”[J. Chem. Phys. 165, 024903 (2026)]
Sathyavani S,R G Joshi,Vignesh A
Sathyavani S
Evolution of the energy landscape for n-alkanes: n-C14H30 to n-C20H42 [0.03%]
正构烷烃的能量景观随碳数的变化：从n-C14H30到n-C20H42
Soon Woo Park,Yuthika Pillai,Philipp Pracht et al.
Soon Woo Park et al.
Unbranched n-alkanes provide useful models for investigating how conformational complexity evolves with chain length. In this work, we examine the energy landscapes of n-C14H30 to n-C20H42 with a Δ-corrected transferable many-body permutat...
Impact of the nuclear model and electron correlation on the parity-violation effects on the electric field gradient [0.03%]
核模型和电子关联对电场梯度的宇称Violation效应的影响
Juan J Aucar,Alejandro F Maldonado
Juan J Aucar
In this work, the parity violation (PV) effects on the electric field gradient (EFG) at a four-component (4c) Density Functional Theory (DFT) level are presented. Such effects were studied previously [J. J. Aucar and A. F. Maldonado, Phys. ...
Revisiting the electronic structure of PtO: Cryogenic photoelectron spectroscopy and relativistic insights [0.03%]
铂氧化学计量态电子结构的再研究：低温光电子能谱和相对论效应分析
Xueying Li,Zhubin Hu,Jian Zhang et al.
Xueying Li et al.
We investigate the electronic structure of PtO via cryogenic anion photoelectron spectroscopy combined with relativistic multireference calculations, clarifying long-standing ambiguities in the assignment of its low-lying electronic manifol...
Publisher's Note: "A microscopic theory of small-droplet adhesion on solid surfaces" [J. Chem. Phys. 165, 024707 (2026)] [0.03%]
出版者附言：“固体表面微小液滴粘附的微观理论”[J. Chem. Phys. 165, 024707 (2026)]
Ruize Yin,Fei Wang,Britta Nestler
Ruize Yin
Published Erratum
The Journal of chemical physics. 2026 Aug 7;165(5):059901. DOI:10.1063/5.0353198 2026
Exploring flat multi-minima potential energy surface by matrix isolation IR spectroscopy: Revisiting methanol-H2S complex [0.03%]
矩阵隔离红外光谱探测平坦势能面中的多极小值：重新探讨甲醇-硫化氢复合物
Ankita Kothari,Binod Kumar Oram,Monu Morwal et al.
Ankita Kothari et al.
An extensive potential energy surface search of the methanol-H2S binary complex reveals four distinct conformers (two each of S-H⋯O and O-H⋯S H-bonded) within a small energy window (binding energies within -2.9 to -3.3 kcal mol-1). The fo...
Para-ortho H2 conversion in collisions with NO: A surprising mechanism [0.03%]
NO与H2碰撞中的(para-正交)H2转化：一种意外的机制
Ad van der Avoird,Gerrit C Groenenboom
Ad van der Avoird
Molecular hydrogen exists in two kinds, para-H2 and ortho-H2, which act as distinct molecules in many physical and chemical processes. Their interconversion is extremely slow but can be catalyzed by collisions with paramagnetic molecules su...
Unbiased exploration of the transition region in ice nucleation using the NpH ensemble [0.03%]
利用NpH系综在冰成核过程中过渡区的无偏探索
Sebastian Falkner,Nadine Schwierz,Pablo Montero de Hijes
Sebastian Falkner
In this work, we employ the isenthalpic-isobaric (NpH) ensemble to sample the transition region of ice nucleation without any external bias, thereby avoiding potentially artificial memory effects introduced by projections onto collective va...