geometry optimization freeware downloads
Ascalaph Quantum
1.7.12 freeware download... and method to account for electron correlation. Optimization: · Geometry optimization is a routine job. The optimization cannot be applied to arbitrary geometry. First, the ...
Ascalaph Designer
1.8.94 freeware download... Using this application you can simulate, molecular graphics, optimization, molecular dynamics, quantum chemistry. Features: ... building Crystal builder Chain Builder Drawing by mouse Geometry editing Preliminary optimization (Ad hoc) Quantum optimization Nanotubes ...
NETGEN
5.3.1 freeware download... 3D problems can be defined by Constructive Solid Geometry (CSG), the standard STL file format, or via ... OpenCascade support. NETGEN provides modules for automated mesh optimization and hierarchical mesh refinement. Curved elements or arbitrary ...
NETGEN for Linux
5.3.1 freeware download... 3D problems can be defined by Constructive Solid Geometry (CSG), the standard STL file format, or via ... OpenCascade support. NETGEN provides modules for automated mesh optimization and hierarchical mesh refinement. Curved elements or arbitrary ...
MOPlot
1.93 freeware download... Cartesian coordinate axes, atom numbers according to the geometry definition in the calculation. Molecules can be turned ... the energy change in the course of a geometry optimization or a "scan" run (similar to Molden). ...