FRINK Linked Data Fragments server

Matches in SemOpenAlex for { <https://semopenalex.org/work/W2890500596> ?p ?o ?g. }

• W2890500596 endingPage "22344" @default.
• W2890500596 startingPage "22339" @default.
• W2890500596 abstract "A naked cyclo-N5– salt has yet to be recovered to ambient conditions, precluding its application as a high-energy density material for explosive or propulsion applications. Here, we suggest a simple route for the synthesis of a metal cyclo-N5– salt via compressing CuN6. Using first-principles calculations with structural search, we predict a CuN5 compound with a cyclo-N5– anion that is energetically favorite in the pressure range of 50–100 GPa. At ambient conditions, CuN5 comprises alternant-connected cyclo-N5– anions and Cu+ ions, forming a zigzag chain. The copper cyclo-N5– salt is thermodynamically stable with a 2.5 eV band gap at ambient conditions. Further analysis of electronic properties reveals that the Cu atoms not only contribute electrons to change the bonding state of N5 rings but also use empty outer-shell orbitals to accommodate lone pair electrons of N atoms, forming coordinate bonds to stabilize the system. This expands the known cyclo-N5– salt and indicates a simple route to its synthesis." @default.
• W2890500596 created "2018-09-27" @default.
• W2890500596 creator A5029101105 @default.
• W2890500596 creator A5032481149 @default.
• W2890500596 creator A5037734167 @default.
• W2890500596 creator A5047191354 @default.
• W2890500596 creator A5048178187 @default.
• W2890500596 date "2018-09-14" @default.
• W2890500596 modified "2023-10-14" @default.
• W2890500596 title "Simple Route to Metal <i>cyclo</i>-N₅^– Salt: High-Pressure Synthesis of CuN₅" @default.
• W2890500596 cites W1970127494 @default.
• W2890500596 cites W1971157516 @default.
• W2890500596 cites W1976099376 @default.
• W2890500596 cites W1979544533 @default.
• W2890500596 cites W1981368803 @default.
• W2890500596 cites W1982133696 @default.
• W2890500596 cites W1987911606 @default.
• W2890500596 cites W1991432121 @default.
• W2890500596 cites W1998396018 @default.
• W2890500596 cites W2006102096 @default.
• W2890500596 cites W2015784024 @default.
• W2890500596 cites W2018936961 @default.
• W2890500596 cites W2021988950 @default.
• W2890500596 cites W2022085321 @default.
• W2890500596 cites W2036113194 @default.
• W2890500596 cites W2040292235 @default.
• W2890500596 cites W2046350634 @default.
• W2890500596 cites W2065586875 @default.
• W2890500596 cites W2066920268 @default.
• W2890500596 cites W2082687692 @default.
• W2890500596 cites W2083222334 @default.
• W2890500596 cites W2088043604 @default.
• W2890500596 cites W2109080918 @default.
• W2890500596 cites W2112024081 @default.
• W2890500596 cites W2119607070 @default.
• W2890500596 cites W2140171692 @default.
• W2890500596 cites W2150687058 @default.
• W2890500596 cites W2167251656 @default.
• W2890500596 cites W2282942319 @default.
• W2890500596 cites W2318875703 @default.
• W2890500596 cites W2410749658 @default.
• W2890500596 cites W2416143897 @default.
• W2890500596 cites W2560266622 @default.
• W2890500596 cites W2582556134 @default.
• W2890500596 cites W2599316109 @default.
• W2890500596 cites W2745942698 @default.
• W2890500596 cites W2757734009 @default.
• W2890500596 cites W2768373768 @default.
• W2890500596 cites W2780952327 @default.
• W2890500596 cites W2783910078 @default.
• W2890500596 cites W2792637693 @default.
• W2890500596 cites W2796029457 @default.
• W2890500596 cites W2950764993 @default.
• W2890500596 cites W431781825 @default.
• W2890500596 cites W4385889257 @default.
• W2890500596 doi "https://doi.org/10.1021/acs.jpcc.8b08924" @default.
• W2890500596 hasPublicationYear "2018" @default.
• W2890500596 type Work @default.
• W2890500596 sameAs 2890500596 @default.
• W2890500596 citedByCount "42" @default.
• W2890500596 countsByYear W28905005962019 @default.
• W2890500596 countsByYear W28905005962020 @default.
• W2890500596 countsByYear W28905005962021 @default.
• W2890500596 countsByYear W28905005962022 @default.
• W2890500596 countsByYear W28905005962023 @default.
• W2890500596 crossrefType "journal-article" @default.
• W2890500596 hasAuthorship W2890500596A5029101105 @default.
• W2890500596 hasAuthorship W2890500596A5032481149 @default.
• W2890500596 hasAuthorship W2890500596A5037734167 @default.
• W2890500596 hasAuthorship W2890500596A5047191354 @default.
• W2890500596 hasAuthorship W2890500596A5048178187 @default.
• W2890500596 hasConcept C121332964 @default.
• W2890500596 hasConcept C143895478 @default.
• W2890500596 hasConcept C145148216 @default.
• W2890500596 hasConcept C147597530 @default.
• W2890500596 hasConcept C147789679 @default.
• W2890500596 hasConcept C178790620 @default.
• W2890500596 hasConcept C185592680 @default.
• W2890500596 hasConcept C192271897 @default.
• W2890500596 hasConcept C198091228 @default.
• W2890500596 hasConcept C2524010 @default.
• W2890500596 hasConcept C2776371256 @default.
• W2890500596 hasConcept C32909587 @default.
• W2890500596 hasConcept C33923547 @default.
• W2890500596 hasConcept C46000676 @default.
• W2890500596 hasConcept C544153396 @default.
• W2890500596 hasConcept C8010536 @default.
• W2890500596 hasConcept C97355855 @default.
• W2890500596 hasConceptScore W2890500596C121332964 @default.
• W2890500596 hasConceptScore W2890500596C143895478 @default.
• W2890500596 hasConceptScore W2890500596C145148216 @default.
• W2890500596 hasConceptScore W2890500596C147597530 @default.
• W2890500596 hasConceptScore W2890500596C147789679 @default.
• W2890500596 hasConceptScore W2890500596C178790620 @default.
• W2890500596 hasConceptScore W2890500596C185592680 @default.
• W2890500596 hasConceptScore W2890500596C192271897 @default.
• W2890500596 hasConceptScore W2890500596C198091228 @default.
• W2890500596 hasConceptScore W2890500596C2524010 @default.

• next