-
2
-
-
38349130747
-
Novel Crystalline Modifications of C.I. Pigment Yellow 181 and Associated Production Method
-
Patent no. WO 2006005408, 19-1-2006
-
Schmidt, M. U.; Mehltretter, G.: Novel Crystalline Modifications of C.I. Pigment Yellow 181 and Associated Production Method. Patent no. WO 2006005408, 19-1-2006.
-
-
-
Schmidt, M.U.1
Mehltretter, G.2
-
3
-
-
33751215866
-
DASH: A Program for Crystal Structure Determination from Powder Diffraction Data
-
David, W. I. F.; Shankland, K.; van de Streek, J.; Pidcock, E.; Motherwell, W. D. S.; Cole, J. C.: DASH: a Program for Crystal Structure Determination from Powder Diffraction Data. J. Appl. Cryst. 39 (2006) 910-915.
-
(2006)
J. Appl. Cryst
, vol.39
, pp. 910-915
-
-
David, W.I.F.1
Shankland, K.2
van de Streek, J.3
Pidcock, E.4
Motherwell, W.D.S.5
Cole, J.C.6
-
4
-
-
0034985563
-
Background Estimation Using a Robust Bayesian Analysis
-
David, W. I. F.; Sivia, D. S.: Background Estimation Using a Robust Bayesian Analysis. J. Appl. Cryst. 34 (2001) 318-324.
-
(2001)
J. Appl. Cryst
, vol.34
, pp. 318-324
-
-
David, W.I.F.1
Sivia, D.S.2
-
5
-
-
0026368044
-
Indexing of Powder Diffraction Patterns for Low-symmetry Lattices by the Successive Dichotomy Method
-
Boultif, A.; Louër, D.: Indexing of Powder Diffraction Patterns for Low-symmetry Lattices by the Successive Dichotomy Method. J. Appl. Cryst. 24 (1991) 987-993.
-
(1991)
J. Appl. Cryst
, vol.24
, pp. 987-993
-
-
Boultif, A.1
Louër, D.2
-
6
-
-
0035146613
-
A Probabilistic Approach to Space-group Determination from Powder Diffraction Data
-
Markvardsen, A. J.; David, W. I. F.; Johnson, J. C.; Shankland, K.: A Probabilistic Approach to Space-group Determination from Powder Diffraction Data. Acta Cryst. A57 (2001) 47-54.
-
(2001)
Acta Cryst. A
, vol.57
, pp. 47-54
-
-
Markvardsen, A.J.1
David, W.I.F.2
Johnson, J.C.3
Shankland, K.4
-
7
-
-
0001752768
-
The Cambridge Structural Database: A Quarter of a Million Crystal Structures and Rising
-
Allen, F. H.: The Cambridge Structural Database: a Quarter of a Million Crystal Structures and Rising. Acta Cryst. B58 (2002) 380-388.
-
(2002)
Acta Cryst
, vol.B58
, pp. 380-388
-
-
Allen, F.H.1
-
8
-
-
38349091049
-
-
Coelho, A. A.: TOPAS-Academic 4.0. (2006).
-
Coelho, A. A.: TOPAS-Academic 4.0. (2006).
-
-
-
-
9
-
-
9144240095
-
-
Mayo, S. L.; Olafson, B. D.; Goddard III, W. A.: DREIDING: A Generic Force Field for Molecular Simulations. J. Phys. Chem. 94 (1990) 8897-8909.
-
Mayo, S. L.; Olafson, B. D.; Goddard III, W. A.: DREIDING: A Generic Force Field for Molecular Simulations. J. Phys. Chem. 94 (1990) 8897-8909.
-
-
-
-
10
-
-
33644783541
-
Ampicillin Trihydrate from Synchrotron Powder Diffraction Data
-
Burley, J. C.; van de Streek, J.; Stephens, P. W.: Ampicillin Trihydrate from Synchrotron Powder Diffraction Data. Acta Cryst. E62 (2006) o797-o799.
-
(2006)
Acta Cryst. E
, vol.62
-
-
Burley, J.C.1
van de Streek, J.2
Stephens, P.W.3
-
11
-
-
38349094994
-
-
2 Version 4.9, 2003
-
2 Version 4.9. (2003).
-
-
-
-
12
-
-
38349138790
-
-
Frisch, M. J, Trucks, G. W, Schlegel, H. B, Scuseria, G. E, Robb, M. A, Cheeseman, J. R, Montgomery Jr, J. A, Vreven, T, Kudin, K. N, Burant, J. C, Millam, J. M, Iyengar, S. S, Tomasi, J, Barone, V, Mennucci, B, Cossi, M, Scalmani, G, Rega, N, Petersson, G. A, Nakatsuji, H, Hada, M, Ehara, M, Toyota, K, Fukuda, R, Hasegawa, J, Ishida, M, Nakajima, T, Honda, Y, Kitao, O, Nakai, H, Klene, M, Li, X, Knox, J. E, Hratchian, H. P, Cross, J. B, Adamo, C, Jaramillo, J, Gomperts, R, Stratmann, R. E, Yazyev, O, Austin, A. J, Cammi, R, Pomelli, C, Ochterski, J. W, Ayala, P. Y, Morokuma, K, Voth, G. A, Salvador, P, Dannenberg, J. J, Zakrzewski, V. G, Dapprich, S, Daniels, A. D, Strain, M. C, Farkas, O, Malick, D. K, Rabuck, A. D, Raghavachari, K, Foresman, J. B, Ortiz, J. V, Cui, Q, Baboul, A. G, Clifford, S, Cioslowski, J, Stefanov, B. B, Liu, G, Liashenko, A, Piskorz, P, Komaromi, I, Martin, R. L, Fox, D. J, Keith, T, Al-Lah
-
Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Scuseria, G. E.; Robb, M. A.; Cheeseman, J. R.; Montgomery Jr., J. A.; Vreven, T.; Kudin, K. N.; Burant, J. C.; Millam, J. M.; Iyengar, S. S.; Tomasi, J.; Barone, V.; Mennucci, B.; Cossi, M.; Scalmani, G.; Rega, N.; Petersson, G. A.; Nakatsuji, H.; Hada, M.; Ehara, M.; Toyota, K.; Fukuda, R.; Hasegawa, J.; Ishida, M.; Nakajima, T.; Honda, Y.; Kitao, O.; Nakai, H.; Klene, M.; Li, X.; Knox, J. E.; Hratchian, H. P.; Cross, J. B.; Adamo, C.; Jaramillo, J.; Gomperts, R.; Stratmann, R. E.; Yazyev, O.; Austin, A. J.; Cammi, R.; Pomelli, C.; Ochterski, J. W.; Ayala, P. Y.; Morokuma, K.; Voth, G. A.; Salvador, P.; Dannenberg, J. J.; Zakrzewski, V. G.; Dapprich, S.; Daniels, A. D.; Strain, M. C.; Farkas, O.; Malick, D. K.; Rabuck, A. D.; Raghavachari, K.; Foresman, J. B.; Ortiz, J. V.; Cui, Q.; Baboul, A. G.; Clifford, S.; Cioslowski, J.; Stefanov, B. B.; Liu, G.; Liashenko, A.; Piskorz, P.; Komaromi, I.; Martin, R. L.; Fox, D. J.; Keith, T.; Al-Laham, M. A.; Peng, C. Y.; Nanayakkara, A.; Challacombe, M.; Gill, P. M. W.; Johnson, B.; Chen, W.; Wong, M. W.; Gonzalez, C.; Pople, J. A.: Gaussian03 Revision B.01. (2003).
-
-
-
-
13
-
-
84986513567
-
Determining Atom-Centered Monopoles from Molecular Electrostatic Potentials. The Need for High Sampling Density in Formamide Conformational Analysis
-
Breneman, C. M.; Wiberg, K. B.: Determining Atom-Centered Monopoles from Molecular Electrostatic Potentials. The Need for High Sampling Density in Formamide Conformational Analysis. J. Comp. Chem. 11 (1990) 361-373.
-
(1990)
J. Comp. Chem
, vol.11
, pp. 361-373
-
-
Breneman, C.M.1
Wiberg, K.B.2
|