| 查看: 636 | 回复: 0 | ||
cheap_81铁杆木虫 (著名写手)
|
[求助]
topos4.0晶体拓扑类型计算的问题
|
|
我输入cif文件以后用ADS来计算，结果如下，简化节点后也是同样的情况。这是为什么？谢谢了 Structure consists of molecules (ZD1). The composition of molecule is H Structure consists of molecules (ZD2). The composition of molecule is H Structure consists of molecules (ZD3). The composition of molecule is H Structure consists of molecules (ZD4). The composition of molecule is H Structure consists of molecules (ZD5). The composition of molecule is H Structure consists of molecules (ZD6). The composition of molecule is H Structure consists of molecules (ZD7). The composition of molecule is H Structure consists of molecules (ZD8). The composition of molecule is H Structure consists of molecules (ZE1). The composition of molecule is C Structure consists of molecules (ZE2). The composition of molecule is C Structure consists of molecules (ZE3). The composition of molecule is C Structure consists of molecules (ZE4). The composition of molecule is C Structure consists of molecules (ZE5). The composition of molecule is C Structure consists of molecules (ZE6). The composition of molecule is C Structure consists of molecules (ZE7). The composition of molecule is C Structure consists of molecules (ZE8). The composition of molecule is C Structure consists of molecules (ZE9). The composition of molecule is C Structure consists of molecules (ZE10). The composition of molecule is C Structure consists of molecules (ZE11). The composition of molecule is C Structure consists of molecules (ZE12). The composition of molecule is C Structure consists of molecules (ZF1). The composition of molecule is N Structure consists of molecules (ZF2). The composition of molecule is N Structure consists of molecules (ZG1). The composition of molecule is O Structure consists of molecules (ZG2). The composition of molecule is O Structure consists of molecules (ZG3). The composition of molecule is O Structure consists of molecules (ZG4). The composition of molecule is O Structure consists of molecules (ZH1). The composition of molecule is Zn Topology for ZD1 -------------------- Atom ZD1 doesn't link with bridge molecular ligands Topology for ZD2 -------------------- Atom ZD2 doesn't link with bridge molecular ligands Topology for ZD3 -------------------- Atom ZD3 doesn't link with bridge molecular ligands Topology for ZD4 -------------------- Atom ZD4 doesn't link with bridge molecular ligands Topology for ZD5 -------------------- Atom ZD5 doesn't link with bridge molecular ligands Topology for ZD6 -------------------- Atom ZD6 doesn't link with bridge molecular ligands Topology for ZD7 -------------------- Atom ZD7 doesn't link with bridge molecular ligands Topology for ZD8 -------------------- Atom ZD8 doesn't link with bridge molecular ligands Topology for ZE1 -------------------- Atom ZE1 doesn't link with bridge molecular ligands Topology for ZE2 -------------------- Atom ZE2 doesn't link with bridge molecular ligands Topology for ZE3 -------------------- Atom ZE3 doesn't link with bridge molecular ligands Topology for ZE4 -------------------- Atom ZE4 doesn't link with bridge molecular ligands Topology for ZE5 -------------------- Atom ZE5 doesn't link with bridge molecular ligands Topology for ZE6 -------------------- Atom ZE6 doesn't link with bridge molecular ligands Topology for ZE7 -------------------- Atom ZE7 doesn't link with bridge molecular ligands Topology for ZE8 -------------------- Atom ZE8 doesn't link with bridge molecular ligands Topology for ZE9 -------------------- Atom ZE9 doesn't link with bridge molecular ligands Topology for ZE10 -------------------- Atom ZE10 doesn't link with bridge molecular ligands Topology for ZE11 -------------------- Atom ZE11 doesn't link with bridge molecular ligands Topology for ZE12 -------------------- Atom ZE12 doesn't link with bridge molecular ligands Topology for ZF1 -------------------- Atom ZF1 doesn't link with bridge molecular ligands Topology for ZF2 -------------------- Atom ZF2 doesn't link with bridge molecular ligands Topology for ZG1 -------------------- Atom ZG1 doesn't link with bridge molecular ligands Topology for ZG2 -------------------- Atom ZG2 doesn't link with bridge molecular ligands Topology for ZG3 -------------------- Atom ZG3 doesn't link with bridge molecular ligands Topology for ZG4 -------------------- Atom ZG4 doesn't link with bridge molecular ligands Topology for ZH1 -------------------- Atom ZH1 doesn't link with bridge molecular ligands ------------------------- Structural group analysis ------------------------- ------------------------- Structural group No 1 ------------------------- Structure consists of molecular complex groups ZD ------------------------- Structural group No 2 ------------------------- Structure consists of molecular complex groups ZD ------------------------- Structural group No 3 ------------------------- Structure consists of molecular complex groups ZD ------------------------- Structural group No 4 ------------------------- Structure consists of molecular complex groups ZD ------------------------- Structural group No 5 ------------------------- Structure consists of molecular complex groups ZD ------------------------- Structural group No 6 ------------------------- Structure consists of molecular complex groups ZD ------------------------- Structural group No 7 ------------------------- Structure consists of molecular complex groups ZD ------------------------- Structural group No 8 ------------------------- Structure consists of molecular complex groups ZD ------------------------- Structural group No 9 ------------------------- Structure consists of molecular complex groups ZE ------------------------- Structural group No 10 ------------------------- Structure consists of molecular complex groups ZE ------------------------- Structural group No 11 ------------------------- Structure consists of molecular complex groups ZE ------------------------- Structural group No 12 ------------------------- Structure consists of molecular complex groups ZE ------------------------- Structural group No 13 ------------------------- Structure consists of molecular complex groups ZE ------------------------- Structural group No 14 ------------------------- Structure consists of molecular complex groups ZE ------------------------- Structural group No 15 ------------------------- Structure consists of molecular complex groups ZE ------------------------- Structural group No 16 ------------------------- Structure consists of molecular complex groups ZE ------------------------- Structural group No 17 ------------------------- Structure consists of molecular complex groups ZE ------------------------- Structural group No 18 ------------------------- Structure consists of molecular complex groups ZE ------------------------- Structural group No 19 ------------------------- Structure consists of molecular complex groups ZE ------------------------- Structural group No 20 ------------------------- Structure consists of molecular complex groups ZE ------------------------- Structural group No 21 ------------------------- Structure consists of molecular complex groups ZF ------------------------- Structural group No 22 ------------------------- Structure consists of molecular complex groups ZF ------------------------- Structural group No 23 ------------------------- Structure consists of molecular complex groups ZG ------------------------- Structural group No 24 ------------------------- Structure consists of molecular complex groups ZG ------------------------- Structural group No 25 ------------------------- Structure consists of molecular complex groups ZG ------------------------- Structural group No 26 ------------------------- Structure consists of molecular complex groups ZG ------------------------- Structural group No 27 ------------------------- Structure consists of molecular complex groups ZH Elapsed time: 6.99 sec. |
回复此楼» 猜你喜欢
在MOF中，有没有羧基参加配位的情况
已经有2人回复
-
招2026年入学上海交通大学博士生，急！！！
已经有1人回复
-
无机化学论文润色/翻译怎么收费?
已经有201人回复
-
理论计算合作
已经有0人回复
-
求高校合作
已经有1人回复
-
27级无机化学申博自荐
已经有2人回复
-
Chemdraw免费软件
已经有0人回复
-
单晶结构解析，各类疑难晶体数据处理和答疑
已经有38人回复
-
这个水相反应有没有催化剂促进发生
已经有4人回复
-
Mn Me3TACN
已经有5人回复
找到一些相关的精华帖子，希望有用哦~
求助：谁能帮忙用topos分析几个diamond简化出的拓扑图的类型
已经有8人回复
- 求助晶体结构图
已经有3人回复
- Topos4.0软件分析MOFs拓扑实例
已经有222人回复
- 用TOPOS分析拓扑时三连接配体的如何设置为中心原子
已经有9人回复
- diamond 与拓扑符号
已经有7人回复
- 请问氢键连结小分子构成的三维结构可以画拓扑结构吗 用什么软件画
已经有10人回复
- MOFs簇合物的拓扑解析结果
已经有8人回复
- 最好的画拓扑图的软件topos及用户指南
已经有202人回复
- 如何用Diamond 画晶体的3D拓扑结构图？
已经有5人回复
- 改变拓扑线的颜色
已经有4人回复
- 用Diamond画好拓朴结构后如何在TOPOS中分析他的符号呢？
已经有9人回复
- 【求助】怎样画出拓扑结构
已经有3人回复
点击这里搜索更多相关资源科研从小木虫开始，人人为我，我为人人
