Structures by: Kulik H. J.
Total: 20
Iron carbonate
CFeO3
Journal of chemical theory and computation (2018)
a=4.694(1)Å b=4.694(1)Å c=15.43(1)Å
α=90.° β=90.° γ=120.°
Cobalt carbonate
CCoO3
Journal of chemical theory and computation (2018)
a=4.6618(5)Å b=4.6618(5)Å c=14.963(2)Å
α=90.° β=90.° γ=120.°
Nickel carbonate
CNiO3
Journal of chemical theory and computation (2018)
a=4.6117(5)Å b=4.6117(5)Å c=14.735(2)Å
α=90.° β=90.° γ=120.°
Manganese carbonate
CMnO3
Journal of chemical theory and computation (2018)
a=4.773(1)Å b=4.773(1)Å c=15.642(1)Å
α=90.° β=90.° γ=120.°
Niobium(IV) oxide - HT
NbO2
Journal of chemical theory and computation (2018)
a=4.8463(1)Å b=4.8463(1)Å c=3.0315(1)Å
α=90.° β=90.° γ=90.°
Molybdenum(V) oxide
MoO2
Journal of chemical theory and computation (2018)
a=4.8473(3)Å b=4.8473(3)Å c=2.8136(3)Å
α=90° β=90° γ=90°
Ruthenium(IV) oxide
O2Ru
Journal of chemical theory and computation (2018)
a=4.4919(8)Å b=4.4919(8)Å c=3.1066(7)Å
α=90.° β=90.° γ=90.°
Iridium(IV) oxide
IrO2
Journal of chemical theory and computation (2018)
a=4.5051(3)Å b=4.5051(3)Å c=3.1586(2)Å
α=90.° β=90.° γ=90.°
Vanadium(IV) oxide - Al-doped
O2V
Journal of chemical theory and computation (2018)
a=4.5546(1)Å b=4.5546(1)Å c=2.8528(1)Å
α=90.° β=90.° γ=90.°
Iron(II) bis(carbodiimide)
C2H2FeN4
Journal of chemical theory and computation (2018)
a=6.6655(7)Å b=8.7923(8)Å c=3.3304(3)Å
α=90.° β=90.° γ=90.°
Titanium selenide
Se2Ti
Journal of chemical theory and computation (2018)
a=3.536(1)Å b=3.536(1)Å c=6.004(1)Å
α=90.° β=90.° γ=120.°
Nickel bis(hydrogencyanamide)
C2H2N4Ni
Journal of chemical theory and computation (2018)
a=6.457(2)Å b=8.768(3)Å c=3.230(1)Å
α=90.° β=90.° γ=90.°
Cobalt bis(cyanamide)
C2H2CoN4
Journal of chemical theory and computation (2018)
a=6.5694(2)Å b=8.8057(2)Å c=3.2621(1)Å
α=90.° β=90.° γ=90.°
Tripotassium hexacyanomanganate(III)
C6K3MnN6
Journal of chemical theory and computation (2018)
a=7.09(9)Å b=10.49(7)Å c=8.46(6)Å
α=90.° β=107.6(2)° γ=90.°
Nickel dihydroxide - beta
H2NiO2
Journal of chemical theory and computation (2018)
a=3.1268(1)Å b=3.1268(1)Å c=4.6060(1)Å
α=90.° β=90.° γ=120.°
Cobalt hydroxide
CoH2O2
Journal of chemical theory and computation (2018)
a=3.186(1)Å b=3.186(1)Å c=4.653(1)Å
α=90.° β=90.° γ=120.°
Manganese hydroxide
H2MnO2
Journal of chemical theory and computation (2018)
a=3.25Å b=3.25Å c=4.48Å
α=90.° β=90.° γ=120.°
C14H11PS
C14H11PS
Journal of the American Chemical Society (2019) 141, 1 431-440
a=8.3118(5)Å b=22.2656(12)Å c=6.2032(3)Å
α=90° β=90° γ=90°
C44H49OP3PtS
C44H49OP3PtS
Journal of the American Chemical Society (2019) 141, 1 431-440
a=16.3750(6)Å b=10.7086(4)Å c=22.9666(9)Å
α=90° β=100.066(2)° γ=90°
C14H11P
C14H11P
Journal of the American Chemical Society (2019) 141, 1 431-440
a=9.5932(10)Å b=16.8116(17)Å c=6.1756(6)Å
α=90° β=90° γ=90°