TY - JOUR AU - Colmenero Ruiz, Francisco AU - Lobato Fernández, Álvaro AU - Timón, Vicente PY - 2022 DO - 10.3390/solids3020026 SN - 2673-6497 UR - https://hdl.handle.net/20.500.14352/92207 T2 - Solids AB - The crystal structure of a copper squarate metal-organic framework is fully determined using first principles methods based in density functional theory. The compressibility of this material is studied by optimizing the structure under different... LA - eng M2 - 374 PB - Multidisciplinary Digital Publishing Institute TI - Compressing the channels in the crystal structure of copper squarate metal-organic framework TY - journal article VL - 3 ER -