# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-12-21T14:56:21+01:00
# Query:
# SELECT data.*
# FROM
#  data JOIN jaltnames
#  ON altname = journal
# WHERE
#  (status is null or status != 'retracted') and
#  (journal_id IN (SELECT DISTINCT(journal_id) FROM jaltnames WHERE altname LIKE 'Energy & Environmental Science') AND volume = 5 AND duplicateof IS NULL AND (status is NULL OR status != 'errors') AND (method is NULL OR method != 'theoretical'))
# ORDER BY file asc
file,a,siga,b,sigb,c,sigc,alpha,sigalpha,beta,sigbeta,gamma,siggamma,vol,sigvol,celltemp,sigcelltemp,diffrtemp,sigdiffrtemp,cellpressure,sigcellpressure,diffrpressure,sigdiffrpressure,thermalhist,pressurehist,compoundsource,nel,sg,sgHall,sgNumber,commonname,chemname,mineral,formula,calcformula,cellformula,Z,Zprime,acce_code,authors,title,journal,year,volume,issue,firstpage,lastpage,doi,method,radiation,wavelength,radType,radSymbol,Rall,Robs,Rref,wRall,wRobs,wRref,RFsqd,RI,gofall,gofobs,gofgt,gofref,duplicateof,optimal,status,flags,svnrevision,date,time,onhold
"1515283","12.1653","0.0016","6.7288","0.0008","10.3724","0.0011","90","","104.751","0.005","90","","821.08","0.17","298","","298","","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- B H8 Li N2 -","- B H8 Li N2 -","- B8 H64 Li8 N16 -","8","2","","He, Teng; Wu, Hui; Wu, Guotao; Wang, Junhu; Zhou, Wei; Xiong, Zhitao; Chen, Juner; Zhang, Tao; Chen, Ping","Borohydride hydrazinates: high hydrogen content materials for hydrogen storage","Energy & Environmental Science","2012","5","2","5686","","10.1039/c2ee03205h","powder diffraction","x-ray","1.5406","CuKα","","","","","","","","0.10167","","1.74","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1515284","12.0187","0.0006","6.49642","0.00032","7.6645","0.0005","90","","90","","90","","598.43","0.06","","","298","","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- B H12 Li N4 -","- B H12 Li N4 -","- B4 H48 Li4 N16 -","4","1","","He, Teng; Wu, Hui; Wu, Guotao; Wang, Junhu; Zhou, Wei; Xiong, Zhitao; Chen, Juner; Zhang, Tao; Chen, Ping","Borohydride hydrazinates: high hydrogen content materials for hydrogen storage","Energy & Environmental Science","2012","5","2","5686","","10.1039/c2ee03205h","powder diffraction","x-ray","1.238","synchrotron","","","","","","","","0.2003","","1.2","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1515285","19.9269","0.001","15.0019","0.0008","21.745","0.0011","90","","102.643","0.0007","90","","6342.9","0.6","296.15","","296.15","","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C62 H91 B2 F8 N5 Ni O4 P4 -","- C62 H91 B2 F8 N5 Ni O4 P4 -","- C248 H364 B8 F32 N20 Ni4 O16 P16 -","4","0.5","","Seu, Candace S.; Appel, Aaron M.; Doud, Michael D.; DuBois, Daniel L.; Kubiak, Clifford P.","Formate oxidation via β-deprotonation in [Ni(PR2NR′2)2(CH3CN)]2+ complexes","Energy & Environmental Science","2012","5","4","6480","","10.1039/c2ee03341k","","","0.71073","MOKα","","0.0533","0.0419","","","0.1308","0.1437","","","","","","1.085","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1515286","16.076","0.004","23.952","0.005","17.49","0.004","90","","108.075","0.003","90","","6402","3","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C54 H80 B Cl3 Mg2 O6 -","- C54 H80 B Cl3 Mg2 O6 -","- C216 H320 B4 Cl12 Mg8 O24 -","4","1","","Guo, Yong-sheng; Zhang, Fan; Yang, Jun; Wang, Fei-fei; NuLi, Yanna; Hirano, Shin-ichi","Boron-based electrolyte solutions with wide electrochemical windows for rechargeable magnesium batteries","Energy & Environmental Science","2012","5","10","9100","","10.1039/c2ee22509c","","","0.71073","MoKα","","0.1442","0.1031","","","0.2969","0.3265","","","","","","1.073","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1515287","12.9569","0.0003","13.0714","0.0003","13.4709","0.0003","77.757","0.001","85.936","0.001","72.074","0.001","2121.33","0.08","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H58 Al Cl5 Mg2 O6 -","- C36 H58 Al Cl5 Mg2 O6 -","- C72 H116 Al2 Cl10 Mg4 O12 -","2","1","","Muldoon, John; Bucur, Claudiu B.; Oliver, Allen G.; Sugimoto, Tsuyoshi; Matsui, Masaki; Kim, Hee Soo; Allred, Gary D.; Zajicek, Jaroslav; Kotani, Yukinari","Electrolyte roadblocks to a magnesium rechargeable battery","Energy & Environmental Science","2012","5","3","5941","","10.1039/c2ee03029b","","","0.71073","MoKα","","0.0478","0.0331","","","0.0735","0.0797","","","","","","1.022","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1515288","16.4151","0.0016","16.5787","0.0016","18.5617","0.0019","90","","109.364","0.001","90","","4765.6","0.8","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C48 H68 B Cl3 Mg2 O6 -","- C48 H68 B Cl3 Mg2 O6 -","- C192 H272 B4 Cl12 Mg8 O24 -","4","1","","Muldoon, John; Bucur, Claudiu B.; Oliver, Allen G.; Sugimoto, Tsuyoshi; Matsui, Masaki; Kim, Hee Soo; Allred, Gary D.; Zajicek, Jaroslav; Kotani, Yukinari","Electrolyte roadblocks to a magnesium rechargeable battery","Energy & Environmental Science","2012","5","3","5941","","10.1039/c2ee03029b","","","0.71073","MoKα","","0.0443","0.0345","","","0.086","0.0925","","","","","","1.03","","","","has coordinates","176729","2020-10-21","18:00:00",""