| 1 |
Finding multiple stationary points of the Gibbs tangent plane distance function via the topographical global initialization
Henderson N, Inthiriba J, Rego MD
Chemical Engineering Research & Design, 124, 271, 2017 |
| 2 |
Efficient location of multiple global minima for the phase stability problem
Nichita DV, Gomez S
Chemical Engineering Journal, 152(1), 251, 2009 |
| 3 |
Ab initio post-HF CCSD(T) calculations for triplet and singlet methylene in four consecutive dunning basis sets with extrapolations to infinite limits for various molecular properties
Neugebauer A, Hafelinger G
International Journal of Molecular Sciences, 6(1-2), 157, 2005 |
| 4 |
Theory of distillation trajectory bundles and its application to the optimal design of separation units: Distillation trajectory bundles at finite reflux
Petlyuk FB, Danilov RY
Chemical Engineering Research & Design, 79(7), 733, 2001 |
| 5 |
Spin-restricted open-shell coupled-cluster theory for excited states
Szalay PG, Gauss J
Journal of Chemical Physics, 112(9), 4027, 2000 |
| 6 |
Cyclopropane center dot center dot center dot sulfur dioxide and ethylene center dot center dot center dot sulfur dioxide van der Waals complexes: A theoretical study
Rayon VM, Sordo JA
Journal of Chemical Physics, 110(1), 377, 1999 |
| 7 |
Six-dimensional quantum calculations of vibration-rotation-tunneling levels of nu(1) and nu(2) HCl-stretching excited (HCl)(2)
Qiu YH, Zhang JZH, Bacic Z
Journal of Chemical Physics, 108(12), 4804, 1998 |
| 8 |
Realistic master equation modeling of relaxation on complete potential energy surfaces : Partition function models and equilibrium results
Ball KD, Berry RS
Journal of Chemical Physics, 109(19), 8541, 1998 |
| 9 |
Graph theoretical generation and analysis of hydrogen-bonded structures with applications to the neutral and protonated water cube and dodecahedral clusters
McDonald S, Ojamae L, Singer SJ
Journal of Physical Chemistry A, 102(17), 2824, 1998 |
| 10 |
Theoretical-Study of the Water Tetramer
Wales DJ, Walsh TR
Journal of Chemical Physics, 106(17), 7193, 1997 |
