# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2025-01-02T13:56:10+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 'Journal of Solid State Chemistry') AND volume = 192 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
"1562944","7.4312","0.0001","7.4312","0.0001","6.2023","0.0001","90","","90","","120","","296.621","0.007","100","2","100","2","","","","","","","","3","P 63/m m c","-P 6c 2c","194","Cesium Nickel Bromide","","","- Br3 Cs Ni -","- Br3 Cs Ni -","- Br6 Cs2 Ni2 -","2","0.0833333","","Raw, Adam D.; Ibers, James A.; Poeppelmeier, Kenneth R.","Syntheses and structure of hydrothermally prepared CsNiX3 (X=Cl, Br, I)","Journal of Solid State Chemistry","2012","192","","34","37","10.1016/j.jssc.2012.03.037","","","0.71073","MoKα","","0.0167","0.0167","","","0.0435","0.0435","","","","","","1.901","","","","has coordinates","265577","2021-05-28","08:34:19",""
"1562945","7.1185","0.0002","7.1185","0.0002","5.9085","0.0001","90","","90","","120","","259.289","0.011","100","2","100","2","","","","","","","","3","P 63/m m c","-P 6c 2c","194","Cesium Nickel Chloride","","","- Cl3 Cs Ni -","- Cl3 Cs Ni -","- Cl6 Cs2 Ni2 -","2","0.0833333","","Raw, Adam D.; Ibers, James A.; Poeppelmeier, Kenneth R.","Syntheses and structure of hydrothermally prepared CsNiX3 (X=Cl, Br, I)","Journal of Solid State Chemistry","2012","192","","34","37","10.1016/j.jssc.2012.03.037","","","0.71073","MoKα","","0.0111","0.0104","","","0.0266","0.0267","","","","","","1.681","","","","has coordinates","265577","2021-05-28","08:34:23",""
"1562946","7.9469","0.0002","7.9469","0.0002","6.6575","0.0002","90","","90","","120","","364.114","0.017","100","2","100","2","","","","","","","","3","P 63/m m c","-P 6c 2c","194","Cesium nickel iodide","","","- Cs I3 Ni -","- Cs I3 Ni -","- Cs2 I6 Ni2 -","2","0.0833333","","Raw, Adam D.; Ibers, James A.; Poeppelmeier, Kenneth R.","Syntheses and structure of hydrothermally prepared CsNiX3 (X=Cl, Br, I)","Journal of Solid State Chemistry","2012","192","","34","37","10.1016/j.jssc.2012.03.037","","","0.71073","MoKα","","0.0106","0.0105","","","0.0358","0.0358","","","","","","3.116","","","","has coordinates","265577","2021-05-28","08:34:27",""
"1562947","5.2273","0.0004","5.1504","0.0003","26.598","0.002","90","","93.165","0.008","90","","715","0.09","110","2","110","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- H4 Li4 O14 Rb2 Se3 -","- H8 Li4 O14 Rb2 Se3 -","- H16 Li8 O28 Rb4 Se6 -","2","0.5","","Komornicka, Dorota; Wołcyrz, Marek; Pietraszko, Adam","Local structure of Rb2Li4(SeO4)3·2H2O by the modeling of X-ray diffuse scattering — from average-structure to microdomain model","Journal of Solid State Chemistry","2012","192","","54","59","10.1016/j.jssc.2012.03.050","","","0.71073","MoKα","","0.0403","0.0352","","","0.0715","0.0732","","","","","","1.158","","","","has coordinates","265578","2021-05-28","09:19:17",""
"1562948","5.2625","0.0011","5.182","0.001","26.762","0.005","90","","93.18","0.03","90","","728.7","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- H4 Li4 O14 Rb2 Se3 -","- H4 Li4 O14 Rb2 Se3 -","- H8 Li8 O28 Rb4 Se6 -","2","0.5","","Komornicka, Dorota; Wołcyrz, Marek; Pietraszko, Adam","Local structure of Rb2Li4(SeO4)3·2H2O by the modeling of X-ray diffuse scattering — from average-structure to microdomain model","Journal of Solid State Chemistry","2012","192","","54","59","10.1016/j.jssc.2012.03.050","","","0.71073","MoKα","","0.0696","0.0536","","","0.0894","0.0934","","","","","","1.108","","","","has coordinates","265578","2021-05-28","09:19:17",""
"1562949","15.3325","0.0003","15.3325","0.0003","26.7223","0.0006","90","","90","","90","","6282","0.2","99","2","99","2","","","","","","","","3","I 4/m c m","-I 4 2c","140","","Tricaesium octadecauranium octatricontaselenide","","- Cs1.5 Se19 U9 -","- Cs1.5 Se19 U9 -","- Cs12 Se152 U72 -","8","0.25","","Oh, George N.; Ibers, James A.","Synthesis, structure, and electrical resistivity of Cs3U18Se38","Journal of Solid State Chemistry","2012","192","","81","86","10.1016/j.jssc.2012.02.035","","","0.71073","MoKα","","0.0245","0.0197","","","0.0405","0.0415","","","","","","1.204","","","","has coordinates","265579","2021-05-28","09:23:18",""
"1562950","5.2931","0.0009","13.209","0.002","13.346","0.002","90","","95.26","0.003","90","","929.2","0.3","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Tetra(aqua)(fumarato)cobalt(II) monohydrate","","- C4 H12 Co O9 -","- C4 H12 Co O9 -","- C16 H48 Co4 O36 -","4","0.5","","Bora, Sanchay J.; Das, Birinchi K.","Synthesis and properties of a few 1-D cobaltous fumarates","Journal of Solid State Chemistry","2012","192","","93","101","10.1016/j.jssc.2012.03.009","","","0.71073","MoKα","","0.0274","0.027","","","0.0749","0.0752","","","","","","1.074","","","","has coordinates","265580","2021-05-28","09:28:05",""
"1562951","11.9058","0.0007","8.9589","0.0006","15.019","0.0009","90","","90","","90","","1601.97","0.17","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Di(aqua)bis(pyridine)(fumarato)cobalt(II)","","- C14 H16 Co N2 O6 -","- C14 H16 Co N2 O6 -","- C56 H64 Co4 N8 O24 -","4","0.5","","Bora, Sanchay J.; Das, Birinchi K.","Synthesis and properties of a few 1-D cobaltous fumarates","Journal of Solid State Chemistry","2012","192","","93","101","10.1016/j.jssc.2012.03.009","","","0.71073","MoKα","","0.0318","0.0276","","","0.0739","0.0768","","","","","","1.104","","","","has coordinates","265580","2021-05-28","09:28:06",""
"1562952","8.9107","0.0002","11.5087","0.0002","8.8982","0.0002","90","","106.593","0.001","90","","874.52","0.03","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Di(aqua)bis(4-cyanopyridine)(fumarato)cobalt(II)","","- C16 H14 Co N4 O6 -","- C16 H14 Co N4 O6 -","- C32 H28 Co2 N8 O12 -","2","0.5","","Bora, Sanchay J.; Das, Birinchi K.","Synthesis and properties of a few 1-D cobaltous fumarates","Journal of Solid State Chemistry","2012","192","","93","101","10.1016/j.jssc.2012.03.009","","","0.71073","MoKα","","0.0239","0.0217","","","0.0585","0.06","","","","","","1.085","","","","has coordinates","265580","2021-05-28","09:28:06",""
"1562953","8.62","0.001","14.9947","0.0017","3.2337","0.0004","90","","90","","90","","417.97","0.09","293","2","293","2","","","","","","","","4","P b a m","-P 2 2ab","55","","","","- B3 Ir1.94 Rh2.38 Ti1.68 -","- B3 Ir1.946 Rh2.377 Ti1.677 -","- B12 Ir7.784 Rh9.508 Ti6.708 -","4","0.5","","Goerens, Christian; Fokwa, Boniface P.T.","The complex metal-rich boride Ti1+xRh2−x+yIr3−yB3 (x=0.68, y=1.06) with a new structure type containing B4 zigzag fragments: Synthesis, crystal chemistry and theoretical calculations","Journal of Solid State Chemistry","2012","192","","113","119","10.1016/j.jssc.2012.04.005","","","0.71073","MoKα","","0.0577","0.0479","","","0.09","0.0931","","","","","","1.158","","","","has coordinates","265581","2021-05-28","09:32:59",""
"1562954","9.1793","0.0018","4.5014","0.0009","17.849","0.004","90","","90","","90","","737.5","0.3","153","2","153","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- Ag Ba4 In Se6 -","- Ag Ba4 In Se6 -","- Ag2 Ba8 In2 Se12 -","2","0.25","","Yin, Wenlong; Feng, Kai; Hao, Wenyu; Yao, Jiyong; Wu, Yicheng","Syntheses, structures, and optical properties of Ba4MInSe6 (M=Cu, Ag)","Journal of Solid State Chemistry","2012","192","","168","171","10.1016/j.jssc.2012.03.068","","","0.71073","MoKα","","0.0406","0.0303","","","0.0542","0.0578","","","","","","1.028","","","","has coordinates","265582","2021-05-28","09:39:15",""
"1562955","9.1181","0.0018","4.472","0.0009","17.681","0.003","90","","90","","90","","721","0.2","153","2","153","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- Ba4 Cu In Se6 -","- Ba4 Cu In Se6 -","- Ba8 Cu2 In2 Se12 -","2","0.25","","Yin, Wenlong; Feng, Kai; Hao, Wenyu; Yao, Jiyong; Wu, Yicheng","Syntheses, structures, and optical properties of Ba4MInSe6 (M=Cu, Ag)","Journal of Solid State Chemistry","2012","192","","168","171","10.1016/j.jssc.2012.03.068","","","0.71073","MoKα","","0.0506","0.0408","","","0.0858","0.09","","","","","","1.122","","","","has coordinates","265582","2021-05-28","09:39:18",""
"1562956","11.688","0.006","16.565","0.009","24.196","0.013","70.949","0.017","78.46","0.02","72.725","0.019","4201","4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C66 H82 Ca4 N2 O51 S8 -","- C66 H40 Ca4 N2 O51 S8 -","- C132 H80 Ca8 N4 O102 S16 -","2","1","","Xiong, Kecai; Jiang, Feilong; Wu, Mingyan; Gai, Yanli; Chen, Qihui; Zhang, Shuquan; Ma, Jie; Han, Dong; Hong, Maochun","Two novel chains based on capsules supported by water-soluble calixarenes and metal complexes","Journal of Solid State Chemistry","2012","192","","215","220","10.1016/j.jssc.2012.04.021","","","0.71073","MoKα","","0.0883","0.0725","","","0.1931","0.2138","","","","","","1.058","","","","has coordinates,has disorder","265583","2021-05-28","09:47:00",""
"1562957","14.1785","0.001","14.3084","0.0012","14.751","0.0012","104.088","0.002","98.284","0.003","94.186","0.004","2854","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H56 Cu3 N2 O37 S8 -","- C34 H17 Cu3 N2 O37 S8 -","- C68 H34 Cu6 N4 O74 S16 -","2","1","","Xiong, Kecai; Jiang, Feilong; Wu, Mingyan; Gai, Yanli; Chen, Qihui; Zhang, Shuquan; Ma, Jie; Han, Dong; Hong, Maochun","Two novel chains based on capsules supported by water-soluble calixarenes and metal complexes","Journal of Solid State Chemistry","2012","192","","215","220","10.1016/j.jssc.2012.04.021","","","0.71073","MoKα","","0.09","0.0704","","","0.1898","0.2096","","","","","","1.055","","","","has coordinates","265583","2021-05-28","09:47:04",""
"1562958","14.509","0.004","6.944","0.002","14.894","0.004","90","","116.283","0.003","90","","1345.4","0.6","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C6 H16 La N O11 S -","- C6 H8 La N O11 S -","- C24 H32 La4 N4 O44 S4 -","4","1","","Zhuang, Gui-lin; Chen, Wu-lin; Zheng, Jun; Yu, Hui-you; Wang, Jian-guo","N-(sulfoethyl) iminodiacetic acid-based lanthanide coordination polymers: Synthesis, magnetism and quantum Monte Carlo studies","Journal of Solid State Chemistry","2012","192","","284","288","10.1016/j.jssc.2012.04.031","","","0.71073","MoKα","","0.0215","0.0203","","","0.0538","0.0544","","","","","","1.118","","","","has coordinates","265584","2021-05-28","09:55:20",""
"1562959","11.5754","0.0002","16.1852","0.0003","8.6096","0.0002","90","","90","","90","","1613.01","0.06","298","2","298","2","","","","","","","","6","P b a 2","P 2 -2ab","32","","","","- C6 H20 N O13 Pr S -","- C6 H8 N O13 Pr S -","- C24 H32 N4 O52 Pr4 S4 -","4","1","","Zhuang, Gui-lin; Chen, Wu-lin; Zheng, Jun; Yu, Hui-you; Wang, Jian-guo","N-(sulfoethyl) iminodiacetic acid-based lanthanide coordination polymers: Synthesis, magnetism and quantum Monte Carlo studies","Journal of Solid State Chemistry","2012","192","","284","288","10.1016/j.jssc.2012.04.031","","","0.71073","MoKα","","0.0299","0.0249","","","0.0615","0.0651","","","","","","1.035","","","","has coordinates","265584","2021-05-28","09:55:24",""
"1562960","11.5413","0.0004","16.1248","0.0005","8.5949","0.0003","90","","90","","90","","1599.52","0.09","298","2","298","2","","","","","","","","6","P b a 2","P 2 -2ab","32","","","","- C6 H20 N Nd O13 S -","- C6 H8 N Nd O13 S -","- C24 H32 N4 Nd4 O52 S4 -","4","1","","Zhuang, Gui-lin; Chen, Wu-lin; Zheng, Jun; Yu, Hui-you; Wang, Jian-guo","N-(sulfoethyl) iminodiacetic acid-based lanthanide coordination polymers: Synthesis, magnetism and quantum Monte Carlo studies","Journal of Solid State Chemistry","2012","192","","284","288","10.1016/j.jssc.2012.04.031","","","0.71073","MoKα","","0.0338","0.0296","","","0.0748","0.0784","","","","","","1.109","","","","has coordinates","265584","2021-05-28","09:55:24",""
"1562961","6.2592","0.0002","15.715","0.0003","6.5644","0.0002","90","","105.862","0.002","90","","621.11","0.03","298","2","298","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C6 H14 Gd N O10 S -","- C6 H8 Gd N O10 S -","- C12 H16 Gd2 N2 O20 S2 -","2","1","","Zhuang, Gui-lin; Chen, Wu-lin; Zheng, Jun; Yu, Hui-you; Wang, Jian-guo","N-(sulfoethyl) iminodiacetic acid-based lanthanide coordination polymers: Synthesis, magnetism and quantum Monte Carlo studies","Journal of Solid State Chemistry","2012","192","","284","288","10.1016/j.jssc.2012.04.031","","","0.71073","MoKα","","0.0218","0.0216","","","0.0534","0.0535","","","","","","1.064","","","","has coordinates","265584","2021-05-28","09:55:24",""
"1562968","4.5555","0.0006","4.5555","0.0006","24.041","0.003","90","","90","","120","","432.07","0.1","295","2","295","2","","","","","","","","3","R -3 m :H","-R 3 2""","166","strontium silver arsenide (1/4/2)","strontium silver arsenide (1/4/2)","","- Ag4 As2 Sr -","- Ag3.992 As2 Sr -","- Ag11.976 As6 Sr3 -","3","0.0833333","","Stoyko, Stanislav S.; Khatun, Mansura; Scott Mullen, C.; Mar, Arthur","Ternary CaCu4P2-type pnictides AAg4Pn2 (A=Sr, Eu; Pn=As, Sb)","Journal of Solid State Chemistry","2012","192","","325","330","10.1016/j.jssc.2012.04.042","","","0.71073","MoKα","","0.0226","0.0223","","","0.0459","0.046","","","","","","1.199","","","","has coordinates","265620","2021-05-31","06:53:41",""
"1562969","4.5352","0.0002","4.5352","0.0002","23.7221","0.0011","90","","90","","120","","422.55","0.03","295","2","295","2","","","","","","","","3","R -3 m :H","-R 3 2""","166","europium silver arsenide (1/4/2)","europium silver arsenide (1/4/2)","","- Ag4 As2 Eu -","- Ag3.996 As2 Eu -","- Ag11.988 As6 Eu3 -","3","0.0833333","","Stoyko, Stanislav S.; Khatun, Mansura; Scott Mullen, C.; Mar, Arthur","Ternary CaCu4P2-type pnictides AAg4Pn2 (A=Sr, Eu; Pn=As, Sb)","Journal of Solid State Chemistry","2012","192","","325","330","10.1016/j.jssc.2012.04.042","","","0.71073","MoKα","","0.0248","0.0248","","","0.0669","0.067","","","","","","1.26","","","","has coordinates","265620","2021-05-31","06:53:42",""
"1562970","4.7404","0.0004","4.7404","0.0004","25.029","0.002","90","","90","","120","","487.08","0.07","295","2","295","2","","","","","","","","3","R -3 m :H","-R 3 2""","166","strontium silver antimonide (1/4/2)","strontium silver antimonide (1/4/2)","","- Ag4 Sb2 Sr -","- Ag4 Sb2 Sr -","- Ag12 Sb6 Sr3 -","3","0.0833333","","Stoyko, Stanislav S.; Khatun, Mansura; Scott Mullen, C.; Mar, Arthur","Ternary CaCu4P2-type pnictides AAg4Pn2 (A=Sr, Eu; Pn=As, Sb)","Journal of Solid State Chemistry","2012","192","","325","330","10.1016/j.jssc.2012.04.042","","","0.71073","MoKα","","0.0152","0.0147","","","0.0365","0.0367","","","","","","1.14","","","","has coordinates","265620","2021-05-31","06:53:42",""
"1562971","4.7239","0.0003","4.7239","0.0003","24.689","0.0017","90","","90","","120","","477.13","0.05","295","2","295","2","","","","","","","","3","R -3 m :H","-R 3 2""","166","europium silver antimonide (1/4/2)","europium silver antimonide (1/4/2)","","- Ag4 Eu Sb2 -","- Ag4 Eu Sb2 -","- Ag12 Eu3 Sb6 -","3","0.0833333","","Stoyko, Stanislav S.; Khatun, Mansura; Scott Mullen, C.; Mar, Arthur","Ternary CaCu4P2-type pnictides AAg4Pn2 (A=Sr, Eu; Pn=As, Sb)","Journal of Solid State Chemistry","2012","192","","325","330","10.1016/j.jssc.2012.04.042","","","0.71073","MoKα","","0.013","0.0123","","","0.0297","0.03","","","","","","1.125","","","","has coordinates","265620","2021-05-31","06:53:42",""