Crystal structures as periodic graphs: the topological genome and graph databases

被引：0
作者：
Olaf Delgado-Friedrichs
Stephen T. Hyde
Michael O’Keeffe
Omar M. Yaghi
机构：
[1] The Australian National University,Department of Applied Mathematics, Research School of Physics and Engineering
[2] Arizona State University,School of Molecular Sciences
[3] University of California,Department of Chemistry
[4] Kavli Energy Nanosciences Institute,undefined
来源：
Structural Chemistry | 2017年 / 28卷
关键词：
Nets; Tilings; Databases; Materials design;
D O I：
暂无
中图分类号：
学科分类号：
摘要：
We call attention to methods of enumerating periodic structures and to the databases that contain them. These provide information essential to the systematic design of crystalline materials. The underlying topology is uniquely specified and identifiable from the Systre key which is thus the topological genome.
引用
收藏
页码：39 / 44
页数：5
相关论文
共 75 条
[1]  
O’Keeffe M(2012)undefined Chem Rev 112 675-702
[2]  
Yaghi OM(2003)undefined Nature 423 705-714
[3]  
Yaghi OM(1981)undefined Zeit Kristallogr 156 295-304
[4]  
O’Keeffe M(1999)undefined Nature 400 644-647
[5]  
Ockwig NW(2005)undefined Discrete Comput Geom 33 67-81
[6]  
Chae HK(2014)undefined Acta Crystallogr A 70 217-228
[7]  
Eddaoudi M(2003)undefined Acta Crystallogr A 59 351-360
[8]  
Kim J(1999)undefined Discrete Comput Geom 21 299-315
[9]  
Brunner GO(2003)undefined Theor Comput Sci 303 431-445
[10]  
Delgado-Friedrichs O(1984)undefined Acta Crystallogr A 40 42-50
12345678