· 量化新新手，请教各位一个orca里测试波函数稳定性的问题。之前看到卢老师提到，高斯里面有stable=opt的操作，不仅可以测试当前波函数稳定性，还可以帮助找到真正基态 … By providing a focus for the development of post-brexit public … · the economic and political fallout has also influenced public opinion, with some questioning whether the long-term benefits of brexit are worth the short-term challenges. · 各位老师好，我在使用cp2k的md模块计算au-h2o体系（324原子），用的一个节点40核，收敛速度特别慢，电子步耗时50s左右，导致每个离子步所需时长在2000-25000s， … Financial services regulation, despite often being one part politics, is not usually associated with such rapid change. The cbp aspires to trigger a deep and wide debate about what brexit should mean for the uk over the next decade or two. · 各位老师同学们好！看了sob 老师的文章，但仍不知道gaussian计算开壳三线态的关键词是opt ub3lyp/6-31g** guess (mix,always) 0 3 吗？进行吸收光谱的计算是 td (nstates= … For those of us who live in the uk and follow the political convulsions unleashed by brexit, it may seem like an eternity since the referendum. · 各位老师好：我在使用cp2k计算钼表面吸附氧分子、氢原子以及铯原子的多粒子共吸附aimd。由于牵涉到氧分子，所以需要考虑自旋极化。在vasp计算中相应的命令 … What has brexit meant for the uk economy? · 请问各位老师，用orca计算开壳单线态和闭壳单线态的单点能量时，输入文件可以像如下这样写吗：开壳单线态：# # 1a_21u_b3lypoptpwpb95sp# !uks ri-pwpb95 d3bj. ,计 … · [cp2k] cp2k添加uks后，轨道能量（最高占据分子轨道）发生变化的原因是什么？ But looking back over the almost five months since the brexit transitional … · 最近在为体系的自旋多重度的设置犯难，有一些疑问希望老师同学们能给解答一下。1. 加uks是不是就开启了自旋非限制性计算？都加uks是不是更合理一些？我发现 不加uks当 … · 看了论坛之前的两个讨论帖子发现在磁矩和自旋多重度设置时给出的结论不一致，有些困惑，特求助各位老师。第一个帖子如下：求助：cp2k优化ni（111）面scf不收敛问 …
Is The Uks Post Brexit Economic Crisis Officially Over
· 量化新新手，请教各位一个orca里测试波函数稳定性的问题。之前看到卢老师提到，高斯里面有stable=opt的操作，不仅可以测试当前波函数稳定性，还可以帮助找到真正基态 … By providing a focus for the development of post-brexit public … · the economic and political fallout has also influenced public opinion,...
