Improved the output accuracy of Analysis calculation.
Fixed a bug that enthalpy values were output incorrectly in some cases.
Fixed a bug that atomic velocity values were incorrect when using Hernandez method other than in a time step of 1 [fs].
Fixed a bug that an overflow error sometimes occurred in calculation with the SW potential.
Fixed a bug that calculation with the Out-of-Plane potential was not done correctly in some cases.
Fixed a bug that the sim2sim converter could not handle infinite chains.

Materials Explorer 4.00.005

Some simple interfaces to Scigress Explorer (CAChe) are added. If Scigress Explorer (CAChe) is installed, you can perform the following from Materials Explorer:
- Launch the program from the [Tools] menu.
- Change the default data folder from [Tools]→[Options].
- Change the background color by from [Tools]→[Options].
When saving benzene structure(s) as Chemical Sample File, the bond type “Aromatic” will be automatically converted to the combination of “Single” and “Double” bond types.
Amorphous Cell Builder provides an option to treat a polymer as United Atom Model.
Fixed a bug that a spreadsheet did not appear in some cases.
Fixed a bug that the manual setting of the plot area did not work properly in Internal Coordinate module.
Fixed some small problems with Molecule Preview.
Fixed some small problems in torsion calculation.

Materials Explorer 4.0

Modeling/Conditions:
- Polymer building (amorphous, infinite chain).
- Partial rotation.
- User templates (crystal structure, conditions).
- Potential assignment rules.
New potentials:
- Erkoc (LJ) for the metal cluster (Cu, Ag, Au, La, Lu, U).
- HaliciogluPound (LJ) for the cubic metal (Al, Ca, Au, Pb, Ni, Pd, Pt, Ag, Cu, Cr, Fe, Li, Mo, W, Na, K).
- FlahiveGraham (Morse) for the bcc and fcc metal (alpha-Fe, Mo, Nb, Ta, V, W, Ag, Au, Cu, Ir, Pb, Pt, Rh, Ni, Pd).
- AMBER Param96, Param98, Param99 for protein.
- KKY for water.
- Klein McDonald HFJ for HF.
Calculation:
- New integrator Hernandez (larger time step).
- Huge output files (2GB or larger).
- Output file size estimation.
Analysis:
- Thermal conductivity (only for ceramics).
- Atomic distance.
- Pressure (X,Y,Z directions).
- Kinetic energy and Potential energy.
Graphics:
- Material smoothness (metal, plastic, etc.).
- External fields view.
- Image cells view.
Tutorial:
- Movie tutorial (Macromedia Flash animation).