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Showing below up to 50 results in range #5,151 to #5,200.

TWP Pt(PCl3)2C2H4 pop.out ; 533 KB
TWP Pt(PCl3)2C2(CN)4 pop.out ; 1.11 MB
Molecule 1 HOMO 1.jpg 750 × 744; 83 KB
Molecule 2 HOMO 1.jpg 750 × 744; 80 KB
Molecule 3 HOMO 1.jpg 750 × 744; 77 KB
Molecule 1 HOMO.jpg 750 × 744; 67 KB
Molecule 2 HOMO.jpg 750 × 744; 66 KB
Molecule 2 HOMO .jpg 750 × 744; 66 KB
Molecule 3 HOMO 1 .jpg 750 × 744; 77 KB
Dimer4fmol.mol ; 2 KB
Dimer5fmol.mol ; 2 KB
Dimer3fmol.mol ; 1 KB
Dimer2fmol.mol ; 2 KB
Dimer1fmol.mol ; 2 KB
Dimer6ffmol.mol ; 1 KB
Nm607 vertexIcubane post2opt results summary.txt ; 466 bytes
Lo.Log 20884.out ; 222 KB
Lo.Log 20885.out ; 323 KB
Structure 1 polythiophene jmol.mol2 ; 2 KB
Structure 4 (fixed Dihedral Jmol).mol2 ; 2 KB
AZIDE.LOG ; 16 KB
SUMMARY R=H.JPG 606 × 380; 34 KB
1W7S FINALgjf.gjf ; 404 KB
Molecule1homo.jpg 750 × 744; 67 KB
Nm607 hexadiene structure1o.jpg 703 × 292; 33 KB
Nm607 hexadiene structure1o clean.jpg 703 × 292; 28 KB
Nm607 vertexIcubane freqNBOMO results summary.txt ; 439 bytes
NM607 HEXADIENE STRUCTURE1 OPT.LOG ; 390 KB
LINEAR INPUT OPT2.LOG ; 152 KB
CYCLIC INPUT OPT.LOG ; 12 KB
LINEAR INPUT OPT.LOG ; 71 KB
Nm607 hexadiene structure1 opt results summary.txt ; 403 bytes
Lo.AB OPT 1.LOG ; 83 KB
More charge B3LYP 6 31G(d).mol ; 4 KB
Lo.ECLIPSED AB.LOG ; 14 KB
Lo.ETHANE OPT 1.LOG ; 63 KB
Lo.ETHANE ECLIPSED 2.LOG ; 15 KB
Bh3 optimisation.txt ; 400 bytes
Rp1207 BCL3 FREQ.LOG ; 27 KB
Rp1207 BH3 MO.LOG ; 33 KB
PATCHETT BCL3 OPT.LOG ; 31 KB
PATCHETT BCL3 FREQ.LOG ; 27 KB
TwistedCyclicFreq.out ; 36 KB
LinearFreq.out ; 39 KB
DiazideFreq.out ; 36 KB
CyclicFreq.out ; 36 KB
NM607 HEXADIENE STRUCTURE2 OPT.LOG ; 205 KB
Nm607 hexadiene structure2 opt results summary.txt ; 370 bytes
Lo.AB FREQ 2.LOG ; 37 KB
Lo.ETHANE FREQ STAG.LOG ; 37 KB