| 中文标题 | 作者 | 论文ID | 分类简称 | 发布时间 |
|---|---|---|---|---|
| 分子防晒霜：水保护吡咯免受辐射损伤 | Melby Johny, Constant A. Schouder, Ahmed Al-Refaie, Lanhai He, Joss Wiese, Henrik Stapelfeldt, Sebastian Trippel, and Jochen K\"upper | 2010.00453 | physics.chem-ph | 2023-04-07 |
| 三氚代甲烷的生成与分析 | Deseada D''iaz Barrero, Thanh-Long Le, Simon Niemes, Stefan Welte, Magnus Schl"osser, Beate Bornschein, Helmut H. Telle | 2304.02495 | physics.chem-ph | 2023-04-06 |
| 绿柱石中水分子的取向和动态 | Vojtv{e}ch Chlan, Martin Adamec, Helena v{S}tv{e}p''ankov''a, Victor G. Thomas, Filip Kadlec | 2210.11160 | physics.chem-ph | 2023-04-05 |
| 一项使用广义活性空间驱动相似重整化群计算有机分子的核激发态的基准研究 | Meng Huang and Francesco A. Evangelista | 2212.04369 | physics.chem-ph | 2023-04-05 |
| Hilbert空间多参矩阵乘积态定制的耦合簇 | Ondrej Demel, Jan Brandejs, Jakub Lang, Jiri Brabec, Libor Veis, Ors Legeza, Jiri Pittner | 2304.01625 | physics.chem-ph | 2023-04-05 |
| 用变分量子特征求解器研究氢化物离子的束缚态、电子解离能和反应性 | Abdul Kalam, Ashok Kumar, Prasanta K. Panigrahi | 2304.00023 | physics.chem-ph | 2023-04-04 |
| 使用受限玻尔兹曼机自动编码器压缩精确波函数 | Anderson D. S. Duraes | 2304.00259 | physics.chem-ph | 2023-04-04 |
| 捕获光活化金属配合物UV-vis光谱中的大相对论和溶剂效应的方法 | Joel Creutzberg, Erik Donovan Hedeg{aa}rd | 2304.00618 | physics.chem-ph | 2023-04-04 |
| 高斯展开的由矢势非局域动能泛函：金属团簇应用 | F. Sarcinella, S. ''Smiga, F. Della Sala, E. Fabiano | 2304.00754 | physics.chem-ph | 2023-04-04 |
| 对称振动模式在相关驱动的电荷迁移中的去相干作用 | J. Vester, V. Despr''e and A. I. Kuleff | 2211.15399 | physics.chem-ph | 2023-04-03 |
| 等离子体增强的氧化还原反应中热能产生和流体流动的作用 | Ieng Wai Un and Yonatan Sivan | 2102.04783 | physics.chem-ph | 2023-03-31 |
| 等离子体辅助光催化中的光热非线性 | Ieng-Wai Un, Yonatan Dubi and Yonatan Sivan | 2106.10072 | physics.chem-ph | 2023-03-31 |
| 高性能GaN HEMTs的无损门电触点：溶液加工的范德华异质结 | Chuanju Wang, Xiangming Xu, Mohamed Nejib Hedhili, Husam N. Alshareef, and Xiaohang Li | 2202.08243 | physics.chem-ph | 2023-03-31 |
| 用耦合常数平均化的交换-相关空穴捕获电子-电子奇点：霍克原子的案例研究 | Lin Hou and Tom J. P. Irons and Yanyong Wang and James W. Furness and Andrew M. Teale and Jianwei Sun | 2303.17149 | physics.chem-ph | 2023-03-31 |
| 常见的阳离子不可极化：从第一性原理分子动力学中添加色散修正对水合结构的影响 | Vojtech Kostal, Philip E. Mason, Hector Martinez-Seara, Pavel Jungwirth | 2303.17273 | physics.chem-ph | 2023-03-31 |
| 环境中的分子：朝向系统化的电子和Drude振子的量子嵌入 | Matej Ditte, Matteo Barborini, Leonardo Medrano Sandonas, Alexandre Tkatchenko | 2303.16250 | physics.chem-ph | 2023-03-30 |
| 极限条件下的电子激发态通过集合密度泛函 | Tim Gould and Derk P. Kooi and Paola Gori-Giorgi and Stefano Pittalis | 2205.07136 | physics.chem-ph | 2023-03-29 |
| 解开纠缠质量作用定律 | A.N. Kirdin, S.V. Stasenko | 2210.00787 | physics.chem-ph | 2023-03-29 |
| 尖晶石结构FeMn2O4中的多面体畸变和异常磁序 | Qiang Zhang, Wei Tian, Roshan K. Nepal, Ashfia Huq, Stephen Nagler, J. F. DiTusa, and Rongying Jin | 2210.15089 | physics.chem-ph | 2023-03-29 |
| 振子与耗散浴相互作用条件下，松原动力学与精确量子动力学的比较 | Adam Prada, Eszter S. P''os and Stuart C. Althorpe | 2211.02042 | physics.chem-ph | 2023-03-29 |
| 氦的碰撞诱导三体极化率 | Jakub Lang, Michal Lesiuk, Michal Przybytek and Bogumil Jeziorski | 2211.10393 | physics.chem-ph | 2023-03-29 |
| 强均匀磁场下的时变核-电子轨道哈特里-福克理论 | Tanner Culpitt, Laurens D.M. Peters, Erik I. Tellgren, Trygve Helgaker | 2212.11040 | physics.chem-ph | 2023-03-29 |
| 表面跳跃的映射方法 | Jonathan R. Mannouch and Jeremy O. Richardson | 2212.11773 | physics.chem-ph | 2023-03-29 |
| 掺杂稀有气体团簇直至第一溶剂壳层完成，CO2-(Rg)n, n = 3-17, Rg = Ar, Kr, Xe | A.J. Barclay, A.R.W. McKellar, and N. Moazzen-Ahmadi | 2302.10355 | physics.chem-ph | 2023-03-29 |
| 降低反应性分子系统神经网络势生成的成本 | Krystof Brezina, Hubert Beck, Ondrej Marsalek | 2303.15521 | physics.chem-ph | 2023-03-29 |