Spartan 14 1.1.4 Full Version Free Download with Serial Key\Crack

Spartan 14 1.1.4 | 653MB

Spartan'14 is the latest release of Wavefunction's flagship Spartan line. In addition to the performance, stability, and functionality provided by more than 20 years of professional software development, the following New Features have been added.

Features: 

New Graphical User Interface Completely reimagined icons and toolbar display. Fully supports touch devices. 

Tab-based visualization option for multiple open documents 

Orbital Energy Diagram provides display of occupied and unoccupied molecular orbitals, accessible from a single and convenient energy diagram table 

Surface Clipping feature accessed via Surface Properties Dialogue allows for visualization inside calculated graphical models 

Calculation of Selected Area feature for composite maps accessed via the Surface Propertied Dialogue 

QSAR and Thermodynamic properties available in the Molecule Properties Dialogue 

spacer Access to the Spartan Spectra and Propertied Database (SSPD) including IR and NMR spectra, molecular and atomic properties, and QSAR descriptors 

NMR Spectra Display now includes COSY, HSQC, and HMBC 

Datamining, Statistical Analysis, and Plotting features available for the  

New Computational Enhancements: 

Calculation of Raman frequencies and intensities, Display of Raman Spectra for Hartree-Fock and DFT models 

Correction scheme for calculated NMR chemical shifts (EDF2 model) provides accuracy to ~ 1.4-1.6 ppm. For 13C, .1 to .15 ppm for 1H, and 3.4 for 19F. 

The T1 thermochemical recipe has been extended to incorporate molecules containing silicon and phosphorous 

Gradients have been implemented for RI-CIS(D) allowing for equilibrium geometries of excited states 

Vibrational frequencies have been parallelized for Hartree-Fock and DFT (parallel suite only) 

Raman spectra can be calculated for Hartree-Fock and DFT 

Full 64-bit implementation has been completed and is available for Wind0ws and Linux 

Date: 2014 

Version: 1.1.4 14 

Developer website: http://www.wavefun.com/ 

Bit depth: 32bit, 64bit 

Language: English 

Medicine: Present 

Information: 

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