Revision: 20818
http://sourceforge.net/p/jmol/code/20818
Author: hansonr
Date: 2015-10-12 12:31:17 +0000 (Mon, 12 Oct 2015)
Log Message:
-----------
Jmol.___JmolVersion="14.3.16_2015.10.11"
new feature: unitcell() function
-- returns unitcell as an array in the form [origin, va, vb, vc]
-- first parameter is optional unitcell itself; absence uses current model's
unit cell.
-- optional last parameter: scale
-- signatures:
unitcell() // uses current unit cell
unitcell(uc) // copies unit cell
unitcell(uc, "reciprocal") // reciprocal lattice for specified unit cell
unitcell("reciprocal") // reciprocal lattice for current model's unit cell
unitcell(ucconv, "primitive","BCC"|"FCC") // convert primitive to
conventional
unitcell("primitive","BCC"|"FCC")
unitcell(ucprim, "conventional","BCC"|"FCC") // convert primitive to
conventional
unitcell("conventional","BCC"|"FCC")
unitcell(origin, [va, vb, vc]) // user-defined unit cell; just produces
[origin, va, vb, vc]
unitcell(origin, pta, ptb, ptc) // user-defined unit cell using four points
-- compatible with UNITCELL command:
UNITCELL @{unitcell("reciprocal")}
draw unitcell
UNITCELL RESET
new feature: point(unitcell, {i, j, k})
-- returns the Cartesian point corresponding to a specific coordinate in a
unit cell system.
-- unitcell is an array of the form [origin, va, vb, vc]
-- {i j k} is a point in the unit cell
-- for general use -- does not require actual setting of the model's unit cell
Modified Paths:
--------------
trunk/Jmol/src/org/jmol/viewer/Jmol.properties
Modified: trunk/Jmol/src/org/jmol/viewer/Jmol.properties
===================================================================
--- trunk/Jmol/src/org/jmol/viewer/Jmol.properties 2015-10-11 15:41:18 UTC
(rev 20817)
+++ trunk/Jmol/src/org/jmol/viewer/Jmol.properties 2015-10-12 12:31:17 UTC
(rev 20818)
@@ -72,19 +72,26 @@
-- signatures:
unitcell() // uses current unit cell
unitcell(uc) // copies unit cell
- unitcell(uc, "reciprocal") // reciprocal lattice for specied unit cell
+ unitcell(uc, "reciprocal") // reciprocal lattice for specified unit cell
unitcell("reciprocal") // reciprocal lattice for current model's unit cell
unitcell(ucconv, "primitive","BCC"|"FCC") // convert primitive to
conventional
unitcell("primitive","BCC"|"FCC")
unitcell(ucprim, "conventional","BCC"|"FCC") // convert primitive to
conventional
unitcell("conventional","BCC"|"FCC")
-
- unitcell(origin, [va, vb, vc])
- unitcell(origin, pta, ptb, ptc)
-
+ unitcell(origin, [va, vb, vc]) // user-defined unit cell; just produces
[origin, va, vb, vc]
+ unitcell(origin, pta, ptb, ptc) // user-defined unit cell using four
points
+ -- compatible with UNITCELL command:
+
+ UNITCELL @{unitcell("reciprocal")}
+ draw unitcell
+ UNITCELL RESET
+
+
new feature: point(unitcell, {i, j, k})
+ -- returns the Cartesian point corresponding to a specific coordinate in a
unit cell system.
-- unitcell is an array of the form [origin, va, vb, vc]
- -- {i j k} is a point in the unitcell
+ -- {i j k} is a point in the unit cell
+ -- for general use -- does not require actual setting of the model's unit
cell
JmolVersion="14.3.16_2015.10.09"
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